SCHEMBL9341522

SCHEMBL9341522

CCc1ccc(C(=S)C=Cc2ccc(C)c(C)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.49
▸ PTGS1 P23219 1/20 0.49
▸ PTGS2 P35354 1/20 0.49
▸ MAOA P21397 3/20 0.43
▸ SMN1; SMN2 Q16637 6/20 0.41
▸ MAOB P27338 3/20 0.41
▸ LMNA P02545 6/20 0.40
▸ HTT P42858 2/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ MAPT P10636 5/20 0.37
▸ KDM4E B2RXH2 4/20 0.37
▸ ALDH1A1 P00352 4/20 0.37
▸ TDP1 Q9NUW8 2/20 0.37
▸ POLB P06746 2/20 0.37
▸ HSP90AA1 P07900 1/20 0.37
▸ TUBB1 Q9H4B7 2/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ GAA P10253 2/20 0.36
▸ AGTR1 P30556 1/20 0.36
▸ TRPV1 Q8NER1 1/20 0.36

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
SCHEMBL9342014 0.86 MAOB (0.51) ALOX5PTGS1PTGS2MAOASMN1; SMN2
SCHEMBL10497272 0.84 THRA (0.45) TDP1KMT2AMEN1RECQL
SCHEMBL9341512 0.82 MAOA (0.46) ALOX5PTGS1PTGS2MAOASMN1; SMN2
SCHEMBL9342426 0.82 PTGS2 (0.44) ALOX5PTGS1PTGS2MAOASMN1; SMN2
SCHEMBL9342270 0.81 SMN1; SMN2 (0.46) ALOX5PTGS1PTGS2MAOASMN1; SMN2
SCHEMBL9779017 0.81 MAOB (0.48) ALOX5PTGS1PTGS2MAOASMN1; SMN2
SCHEMBL9342232 0.81 SMN1; SMN2 (0.44) ALOX5PTGS1PTGS2MAOASMN1; SMN2
SCHEMBL9341978 0.81 SMN1; SMN2 (0.42) ALOX5PTGS1PTGS2MAOASMN1; SMN2
SCHEMBL9337818 0.81 HDAC4 (0.45) ALOX5PTGS1PTGS2MAOASMN1; SMN2
SCHEMBL9338502 0.79 ABCG2 (0.56) SMN1; SMN2LMNANPSR1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0328668-B1 NONLINEAR OPTICAL MATERIAL NIPPON OILS & FATS CO LTD (JP) 1994-05-25 — — EP disclosed
US-5045239-A Chalcone derivative NIPPON OIL AND FATS CO., LTD. (JP) 1991-09-03 — — US disclosed
EP-0328668-A1 NONLINEAR OPTICAL MATERIAL NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 — — EP disclosed
Send feedback