SCHEMBL9487565

SCHEMBL9487565

COOc1cccc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 9/20 0.52
ALDH1A1 P00352 4/20 0.47
HSD17B10 Q99714 2/20 0.47
PGR P06401 1/20 0.47
GAA P10253 1/20 0.47
PTGS1 P23219 1/20 0.47
MAPK1 P28482 1/20 0.47
HTR1D P28221 1/20 0.47
MAPT P10636 1/20 0.47
SLC6A4 P31645 2/20 0.46
KDM4E B2RXH2 2/20 0.46
HRH1 P35367 1/20 0.46
NR2E1 Q9Y466 1/20 0.44
CYP2A6 P11509 1/20 0.44
KCNA3 P22001 1/20 0.44
HPGD P15428 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL30272529 1.00 HTR1B (0.52) HTR1BALDH1A1HSD17B10PGRGAA
SCHEMBL4289478 0.85 HTR1B (0.59) HTR1BALDH1A1HSD17B10PGRGAA
SCHEMBL30373629 0.81 MAPT (0.61) HTR1BALDH1A1HSD17B10PGRGAA
SCHEMBL28676783 0.81 HTR1B (0.55) HTR1BALDH1A1HSD17B10PGRGAA
SCHEMBL29367279 0.81 MAPT (0.61) HTR1BALDH1A1HSD17B10PGRGAA
SCHEMBL151449 0.81 MAPT (0.61) HTR1BALDH1A1HSD17B10PGRGAA
SCHEMBL28602414 0.79 MAPT (0.59) HTR1BALDH1A1HSD17B10PGRGAA
Methane SCHEMBL28597903 0.79 MAPT (0.59) HTR1BALDH1A1HSD17B10PGRGAA
1,2-Dimethoxybenzene SCHEMBL20581614 0.79 CA12 (0.62) HTR1BALDH1A1HSD17B10PGRGAA
Ammonia Solution, Strong SCHEMBL229215 0.79 MAPT (0.59) HTR1BALDH1A1HSD17B10PGRGAA

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4338438-A Cephalosporin antibiotics MERCK & CO., INC. (US) 1982-07-06 US claimed
WO-2022255888-A1 TARGETED PROTEIN DEGRADATION USING BIFUNCTIONAL COMPOUNDS THAT BIND UBIQUITIN LIGASE AND TARGET MCL-1 PROTEIN CAPTOR THERAPEUTICS S.A. (PL) 2022-12-08 WO disclosed
EP-0273590-B1 STABILIZATION OF KETAZINE DYES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-01-13 EP disclosed
US-4795697-A WITH POLYVINYLCHLORIDE, PHOTOTHERMOGRAPHY MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-01-03 US disclosed
EP-0194026-B1 PHOTOTHERMOGRAPHIC STABILIZERS FOR SYRINGALDAZINE LEUCO DYES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-11-09 EP disclosed
EP-0273590-A2 Stabilization of ketazine dyes MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-07-06 EP disclosed
EP-0194025-A1 Photothermographic toners MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1986-09-10 EP disclosed
EP-0194026-A1 Photothermographic stabilizers for syringaldazine leuco dyes MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1986-09-10 EP disclosed
US-4587211-A Photothermographic stabilizers for syringaldazine leuco dyes MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1986-05-06 US disclosed
US-4585734-A Photothermographic toners MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1986-04-29 US disclosed
US-4123282-A PHTHALAZINE, AROMATIC ACID OR ANHYDRIDE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1978-10-31 US disclosed