SCHEMBL11222538

SCHEMBL11222538

CC(=O)CC(=O)N(C(=O)CC(C)=O)c1ccc(-c2cccc(Cl)c2)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 1/20 0.44
▸ AOC3 Q16853 3/20 0.43
▸ TAAR1 Q96RJ0 2/20 0.41
▸ FFAR1 O14842 1/20 0.41
▸ DCLRE1B Q9H816 1/20 0.40
▸ FSCN1 Q16658 1/20 0.40
▸ ESR2 Q92731 1/20 0.40
▸ ALOX5 P09917 1/20 0.40
▸ SLC6A7 Q99884 1/20 0.39
▸ GRIN2B Q13224 1/20 0.38
▸ GRM5 P41594 1/20 0.38
▸ MMP2 P08253 1/20 0.38
▸ MMP9 P14780 1/20 0.38
▸ MMP8 P22894 1/20 0.38
▸ GABRP O00591 1/20 0.38
▸ GABRD O14764 1/20 0.38
▸ GABRA1 P14867 1/20 0.38
▸ GABRB1 P18505 1/20 0.38
▸ GABRG2 P18507 1/20 0.38
▸ GABRB3 P28472 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
SCHEMBL11429495 0.75 MAPT (0.44) —
SCHEMBL7599236 0.75 HTT (0.44) FSCN1GABRPGABRDGABRA1GABRB1
SCHEMBL8995832 0.74 HSD17B2 (0.41) DHODHGRIN2BMME
SCHEMBL7595407 0.71 TSHR (0.41) FSCN1
SCHEMBL11222060 0.70 HSD17B1 (0.46) DHODHFFAR1
SCHEMBL22624267 0.69 TAAR1 (0.59) TAAR1FFAR1DCLRE1BESR2ALOX5
SCHEMBL21979302 0.68 HTR3E (0.53) —
SCHEMBL10947114 0.68 GAA (0.40) FSCN1
SCHEMBL11427097 0.68 HCRTR1 (0.38) —
SCHEMBL11705566 0.68 ALDH1A1 (0.56) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4331443-A Concentrated solutions of water-insoluble coupling components HOECHST AKTIENGESELLSCHAFT (DE) 1982-05-25 — — US disclosed
US-4221709-A Azo pigments DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 1980-09-09 — — US disclosed
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