SCHEMBL444563

SCHEMBL444563

C[CH]OC(=O)Oc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
ALDH1A1 P00352 2/20 0.44
USP2 O75604 1/20 0.42
ATM Q13315 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
HPGD P15428 2/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ELANE P08246 1/20 0.41
RAD51 Q06609 1/20 0.40
GAA P10253 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HSP90AA1 P07900 1/20 0.39
NSD2 O96028 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HTR1A P08908 1/20 0.38

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
SCHEMBL30753408 0.84 MAPT (0.42) MAPTALDH1A1USP2ATML3MBTL1
SCHEMBL6890425 0.82 LMNA (0.55) MAPTALDH1A1USP2L3MBTL1TDP1
SCHEMBL6894569 0.82 CES2 (0.47) MAPTALDH1A1ATMGAASMN1; SMN2
SCHEMBL1051575 0.81 TDP1 (0.44) MAPTALDH1A1USP2ATML3MBTL1
SCHEMBL6890525 0.80 LMNA (0.61) MAPTALDH1A1ALOX15HSD17B10GAA
SCHEMBL6895059 0.80 CES2 (0.49) MEN1KMT2A
SCHEMBL18073 0.79 TDP1 (0.54) MAPTALDH1A1USP2ATML3MBTL1
SCHEMBL9353455 0.79 TDP1 (0.54) MAPTALDH1A1USP2ATML3MBTL1
SCHEMBL9353461 0.79 TDP1 (0.54) MAPTALDH1A1USP2ATML3MBTL1
SCHEMBL9241160 0.79 TDP1 (0.54) MAPTALDH1A1USP2ATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2189443-B1 TRICYCLIC AMIDE COMPOUND RES FOUND ITSUU LAB (JP) 2013-10-23 EP claimed
US-4560751-A CYCLIZATION OF AMIDO-THIOAMIDE COMPOUND BASF AKTIENGESELLSCHAFT (DE) 1985-12-24 US claimed
US-4250090-A COLORFASTNESS; WETFASTNESS; ACID AZO DYES BASF AKTIENGESELLSCHAFT (DE) 1981-02-10 US claimed
WO-2023210623-A1 HALOALKYL SULFONE ANILIDE COMPOUND AND HERBICIDE CONTAINING SAME 株式会社エス・ディー・エス バイオテック 2023-11-02 WO disclosed
EP-2910560-B1 SILICON-CONTAINING CARBOXYLIC ACID DERIVATIVE KEMPHYS LTD (JP) 2017-09-06 EP disclosed
US-9353134-B2 Silicon-containing carboxylic acid derivative KEMPHYS LTD. (JP) 2016-05-31 US disclosed
EP-2910560-A1 SILICON-CONTAINING CARBOXYLIC ACID DERIVATIVE Kemphys Ltd. (JP) 2015-08-26 EP disclosed
US-20150232487-A1 SILICON-CONTAINING CARBOXYLIC ACID DERIVATIVE KEMPHYS LTD. (JP) 2015-08-20 US disclosed
US-8895769-B2 Silicon-containing carboxylic acid derivative KEMPHYS LTD. (JP) 2014-11-25 US disclosed
US-8895317-B2 Reagent for measuring active nitrogen THE UNIVERSITY OF TOKYO (JP) 2014-11-25 US disclosed
US-20140335517-A1 DETECTION AND TREATMENT OF SCHIZOPHRENIA RENASCIENCE CO LTD (JP) 2014-11-13 US disclosed
US-4694075-A DISAZO DYES FOR PAPER BASF AKTIENGESELLSCHAFT (DE) 1987-09-15 US disclosed
EP-0218206-A2 Disazo pigments having a piperazine bridging member BASF Aktiengesellschaft (DE) 1987-04-15 EP disclosed
EP-0189836-A1 Basic azo dyes BASF Aktiengesellschaft (DE) 1986-08-06 EP disclosed
EP-0100018-B1 PROCESS FOR THE PRODUCTION OF 2-N,N-DISUBSTITUTED AMINOTHIAZOLES BASF Aktiengesellschaft (DE) 1986-04-02 EP disclosed
US-4560751-A CYCLIZATION OF AMIDO-THIOAMIDE COMPOUND BASF AKTIENGESELLSCHAFT (DE) 1985-12-24 US disclosed
EP-0100018-A1 Process for the production of 2-N,N-disubstituted aminothiazoles BASF Aktiengesellschaft (DE) 1984-02-08 EP disclosed
EP-0035116-A2 Azo dyestuffs and dyestuff mixtures and their use in dyeing polyesters BASF Aktiengesellschaft (DE) 1981-09-09 EP disclosed
EP-0034716-A1 Navy blue dyestuff mixtures and their use in dyeing polyesters BASF Aktiengesellschaft (DE) 1981-09-02 EP disclosed
US-4250090-A COLORFASTNESS; WETFASTNESS; ACID AZO DYES BASF AKTIENGESELLSCHAFT (DE) 1981-02-10 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 (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-20150232487-A1 SILICON-CONTAINING CARBOXYLIC ACID DERIVATIVE CA6, CXCR6, CCR6 MAPT 4049/4885ALDH1A1 4163/4885USP2 2518/4885

“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.