SCHEMBL4603115

SCHEMBL4603115

OCCN=Cc1ccccc1O

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 7/20 0.81
CA2 P00918 7/20 0.81
KDM4E B2RXH2 2/20 0.81
CA9 Q16790 6/20 0.75
CA1 P00915 1/20 0.53
SIRT2 Q8IXJ6 1/20 0.52
ALDH1A1 P00352 4/20 0.46
GAA P10253 3/20 0.46
MAPT P10636 2/20 0.46
HPGD P15428 2/20 0.46
POLB P06746 1/20 0.46
THRB P10828 1/20 0.46
ALOX15 P16050 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CTRC Q99895 1/20 0.46
DUSP3 P51452 1/20 0.46
PTPN5 P54829 1/20 0.46
PTPN11 Q06124 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4603113 1.00 CA12 (0.81) CA12CA2KDM4ECA9CA1
SCHEMBL31404237 1.00 CA12 (0.81) CA12CA2KDM4ECA9CA1
SCHEMBL12545899 1.00 CA12 (0.81) CA12CA2KDM4ECA9CA1
N,N'-Disalicylalethylenediamine SCHEMBL18852430 0.90 CA12 (1.00) CA12CA2KDM4ECA9CA1
N,N'-Disalicylalethylenediamine SCHEMBL711494 0.90 CA12 (1.00) CA12CA2KDM4ECA9CA1
N,N'-Disalicylalethylenediamine SCHEMBL11613427 0.90 CA12 (1.00) CA12CA2KDM4ECA9CA1
N,N'-Disalicylalethylenediamine SCHEMBL4290399 0.90 CA12 (1.00) CA12CA2KDM4ECA9CA1
N,N'-Disalicylalethylenediamine SCHEMBL29356999 0.90 CA12 (1.00) CA12CA2KDM4ECA9CA1
N,N'-Disalicylalethylenediamine SCHEMBL22229 0.90 CA12 (1.00) CA12CA2KDM4ECA9CA1
N,N'-Disalicylalethylenediamine SCHEMBL247862 0.90 CA12 (1.00) CA12CA2KDM4ECA9CA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230340197-A1 SCHIFF BASE INCORPORATED DOUBLE METAL CYANIDE CATALYST FOR THE PRODUCTION OF POLYETHER POLYOLS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2023-10-26 US claimed
EP-1194633-B1 AGENT FOR COLORING FIBERS AND METHOD FOR TEMPORARILY COLORING FIBERS WELLA AG (DE) 2008-04-30 EP claimed
US-7056348-B2 5-aryl-1,3,3-trimethyl-2-methylene-indoline derivatives and salts thereof, methods for the production and use of said compounds for the temporary coloration of fibers WELLA AG (DE) 2006-06-06 US claimed
EP-1404289-A1 1-BENZOPYRANE-DERIVATIVES AND COLOURING AGENTS CONTAINING THE SALTS THEREOF Wella Aktiengesellschaft (DE) 2004-04-07 EP claimed
US-6669739-B2 Agent for coloring fibers and method for temporarily coloring fibers WELLA AKTIENGESELLSCHAFT (DE) 2003-12-30 US claimed
US-20030213071-A1 5-Aryl-1.3.3.-trimethyl-2-methylene-indoline derivatives and salts thereof, methods for the production and use of said compounds for the temporary coloration of fibres Wella GmbH (DE) 2003-11-20 US claimed
US-20030196281-A1 1-benzopyrane-derivatives and colouring agents containing the salts thereof WELLA AKTIENGESELLSCHAFT (DE) 2003-10-23 US claimed
EP-1280773-A1 5-ARYL-1.3.3.-TRIMETHYL-2-METHYLENE-INDOLINE DERIVATIVES AND SALTS THEREOF, METHODS FOR THE PRODUCTION AND USE OF SAID COMPOUNDS FOR THE TEMPORARY COLORATION OF FIBRES Wella Aktiengesellschaft (DE) 2003-02-05 EP claimed
WO-2003000214-A1 1-BENZOPYRANE-DERIVATIVES AND COLOURING AGENTS CONTAINING THE SALTS THEREOF WELLA AKTIENGESELLSCHAFT (DE) 2003-01-03 WO claimed
US-20020172651-A1 Agent for coloring fibers and method for temporarily coloring fibers WELLA INTERNATIONAL OPERATIONS SWITZERLAND SARL (CH) 2002-11-21 US claimed
WO-2002085854-A1 5-ARYL-1.3.3.-TRIMETHYL-2-METHYLENE-INDOLINE DERIVATIVES AND SALTS THEREOF, METHODS FOR THE PRODUCTION AND USE OF SAID COMPOUNDS FOR THE TEMPORARY COLORATION OF FIBRES WELLA AKTIENGESELLSCHAFT (DE) 2002-10-31 WO claimed
EP-1194633-A1 AGENT FOR COLORING FIBERS AND METHOD FOR TEMPORARILY COLORING FIBERS Wella Aktiengesellschaft (DE) 2002-04-10 EP claimed
WO-2001086057-A1 AGENT FOR COLORING FIBERS AND METHOD FOR TEMPORARILY COLORING FIBERS WELLA AKTIENGESELLSCHAFT (DE) 2001-11-15 WO claimed
US-12552744-B2 Method for producing monosulfoxide derivative KUMIAI CHEMICAL INDUSTRY CO. LTD. (JP) 2026-02-17 US disclosed
WO-2025004059-A1 SYNTHESIS OF POLYETHER POLYOLS BASED LOW DOSAGE GAS HYDRATE INHIBITORS USING DOUBLE METAL CYANIDE CATALYST COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2025-01-02 WO disclosed
US-20230340197-A1 SCHIFF BASE INCORPORATED DOUBLE METAL CYANIDE CATALYST FOR THE PRODUCTION OF POLYETHER POLYOLS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2023-10-26 US disclosed
WO-2001086057-A1 AGENT FOR COLORING FIBERS AND METHOD FOR TEMPORARILY COLORING FIBERS WELLA AKTIENGESELLSCHAFT (DE) 2001-11-15 WO disclosed
US-4197408-A COPPER COMPLEX CATALYST, 2,5-DIMETHYL-2,4-HEXADIEN) REACTED WITH DIAZOACETATE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-04-08 US disclosed
US-4029690-A WITH 2,5-DIMETHYL-2,4-HEXADIENE AND AN ALKYL DIAZOACETATE WITH A COPPER COMPLEX CATALYST SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-06-14 US disclosed
US-4029683-A WITH A SCHIFF BASE, CHRYSANTHEMATE SYNTHESIS CATALYST SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-06-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030213071-A1 5-Aryl-1.3.3.-trimethyl-2-methylene-indoline derivatives and salts thereof, methods for the production and use of said compounds for the temporary coloration of fibres INMT, KRT18, IPO5 CA12 818/4885CA2 2480/4885KDM4E 884/4885
US-20030196281-A1 1-benzopyrane-derivatives and colouring agents containing the salts thereof KRT18, COL2A1, PHB1 CA12 187/4885CA2 44/4885KDM4E 3406/4885
US-12552744-B2 Method for producing monosulfoxide derivative DDT, HVCN1, TST CA12 931/4885CA2 667/4885KDM4E 1627/4885
US-20020172651-A1 Agent for coloring fibers and method for temporarily coloring fibers ENO1, H1-5, H1-2 CA12 478/4885CA2 760/4885KDM4E 4246/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.