SCHEMBL4592612

SCHEMBL4592612

OC(Cl)(Cl)c1ccccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 3/20 0.46
TSHR P16473 6/20 0.45
LMNA P02545 2/20 0.45
CYP19A1 P11511 3/20 0.42
ALDH1A1 P00352 2/20 0.42
HTR2A P28223 2/20 0.42
HTR2C P28335 2/20 0.42
OPRK1 P41145 2/20 0.42
KCNH2 Q12809 2/20 0.42
ADRA1A P35348 1/20 0.42
CYP3A4 P08684 3/20 0.40
CYP3A5 P20815 1/20 0.40
KIF11 P52732 1/20 0.38
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
MAPK1 P28482 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
KCNA3 P22001 2/20 0.35
TRPA1 O75762 1/20 0.34
CYP1A2 P05177 2/20 0.34

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
SCHEMBL11498640 0.82 KCNN4 (0.45) KCNN4TSHRLMNACYP19A1ALDH1A1
SCHEMBL29617470 0.80 TSHR (0.53) KCNN4TSHRLMNACYP19A1ALDH1A1
SCHEMBL197704 0.80 TSHR (0.53) KCNN4TSHRLMNACYP19A1ALDH1A1
SCHEMBL82703 0.80 TSHR (0.44) KCNN4TSHRLMNACYP19A1ALDH1A1
SCHEMBL11489146 0.80 KCNN4 (0.43) KCNN4TSHRLMNACYP19A1ALDH1A1
SCHEMBL27641406 0.80 KCNN4 (0.43) KCNN4TSHRLMNACYP19A1ALDH1A1
SCHEMBL4475144 0.78 TSHR (0.50) KCNN4TSHRLMNACYP19A1ALDH1A1
Fluoride SCHEMBL11730018 0.78 TSHR (0.50) KCNN4TSHRLMNACYP19A1ALDH1A1
Hydrochloric Acid SCHEMBL9269217 0.78 TSHR (0.50) KCNN4TSHRLMNACYP19A1ALDH1A1
SCHEMBL4298643 0.77 KCNN4 (0.45) KCNN4TSHRLMNACYP19A1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108745222-B Anti-sedimentation type microreactor and synthesis system 华北电力大学 2023-09-01 CN disclosed
EP-2817366-B9 MIXED ALKYL BENZYL ESTER OF SUCCINIC ACID AS SOFTENER LANXESS DEUTSCHLAND GMBH (DE) 2017-09-06 EP disclosed
EP-2817366-B1 MIXED ALKYL BENZYL ESTER OF SUCCINIC ACID AS SOFTENER LANXESS DEUTSCHLAND GMBH (DE) 2017-04-12 EP disclosed
EP-2817366-A1 MIXED ALKLY BENZYL ESTERS OF SUCCINIC ACID USED AS PLASTICIZERS Lanxess Deutschland GmbH (DE) 2014-12-31 EP disclosed
WO-2013124318-A1 MIXED ALKLY BENZYL ESTERS OF SUCCINIC ACID USED AS PLASTICIZERS LANXESS DEUTSCHLAND GMBH (DE) 2013-08-29 WO disclosed
EP-2631266-A1 Mixed alkyl benzyl ester of succinic acid as softener Lanxess Deutschland GmbH (DE) 2013-08-28 EP disclosed
US-20080004387-A1 Alkyl benzyl esters of polycarboxylic acids LANXESS DEUTSCHLAND GMBH (DE) 2008-01-03 US disclosed
EP-1873198-A1 Mixtures of alkyl esters and benzyl esters of polycarboxylic acids Lanxess Deutschland GmbH (DE) 2008-01-02 EP disclosed
US-7105500-B2 Process for the antimicrobial treatment of fiber materials CIBA SPECIALTY CHEMICALS CORP. (US) 2006-09-12 US disclosed
US-20050080044-A1 Process for the antimicrobial treatment of fiber materials HUNTSMAN INTERNATIONAL LLC 2005-04-14 US disclosed
US-20010055651-A1 PROCESS FOR THE TREATMENT OF TEXTILE MATERIALS WITH AN ANTIMICROBIAL AGENT CIBA SPECIALTY CHEMICALS CORP. 2001-12-27 US disclosed
EP-1141453-A1 INCORPORATION OF ORGANIC ANTI-MICROBIALS INTO FIBRES DURING A FIBRE SPINNING PROCESS Ciba SC Holding AG (CH) 2001-10-10 EP disclosed
WO-2000026447-A1 INCORPORATION OF ORGANIC ANTI-MICROBIALS INTO FIBRES DURING A FIBRE SPINNING PROCESS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-05-11 WO disclosed
EP-0937812-A2 Process for the treatment of nonwovens with antimicrobial agents Ciba SC Holding AG (CH) 1999-08-25 EP disclosed
EP-0914085-A2 CONCENTRATED LIQUID ACCUMULATIONS COMPRISING A MICROBICIDALLY ACTIVE INGREDIENT Ciba SC Holding AG (CH) 1999-05-12 EP disclosed
EP-0908553-A2 Process for the treatment of textile materials with an antimicrobial agent Ciba SC Holding AG (CH) 1999-04-14 EP disclosed
WO-1997046218-A2 CONCENTRATED LIQUID FORMULATIONS COMPRISING A MICROBICIDALLY ACTIVE INGREDIENT CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1997-12-11 WO disclosed
EP-0777717-A2 SURFACE-ACTIVE FORMULATIONS Ciba SC Holding AG (CH) 1997-06-11 EP disclosed
WO-1996006153-A2 SURFACE-ACTIVE FORMULATIONS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1996-02-29 WO disclosed
EP-0259249-A2 Microbicidal preparations CIBA-GEIGY AG (CH) 1988-03-09 EP 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 (1 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-20050080044-A1 Process for the antimicrobial treatment of fiber materials NOD2, AAAS, C9 KCNN4 4020/4885TSHR 2726/4885LMNA 339/4885

“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.