SCHEMBL9338384

SCHEMBL9338384

CCc1ccc(C(=S)C=Cc2ccc(C(C)=O)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 3/20 0.51
▸ LMNA P02545 7/20 0.48
▸ MAOA P21397 2/20 0.47
▸ SMN1; SMN2 Q16637 5/20 0.46
▸ MAPT P10636 3/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ ATM Q13315 1/20 0.46
▸ RAB9A P51151 2/20 0.45
▸ KMT2A Q03164 4/20 0.45
▸ HTT P42858 3/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.43
▸ HPGD P15428 2/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ ALOX12 P18054 1/20 0.41

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 0.91 MAOB (0.51) MAOBLMNAMAOASMN1; SMN2MAPT
SCHEMBL9338546 0.88 PTGS2 (0.44) MAOBLMNAMAOASMN1; SMN2MAPT
SCHEMBL9338013 0.85 PTGS2 (0.44) MAOBLMNAMAOASMN1; SMN2MAPT
SCHEMBL10497573 0.84 THRA (0.52) KMT2AMEN1TDP1RECQLCYP1A2
SCHEMBL9341575 0.83 MAOB (0.46) MAOBLMNAMAOASMN1; SMN2MAPT
SCHEMBL12243313 0.81 HSD17B1 (0.50) MAOBLMNAMAOASMN1; SMN2MAPT
SCHEMBL9342248 0.81 BCHE (0.44) MAOBLMNAMAOASMN1; SMN2MAPT
SCHEMBL9342772 0.81 THRA (0.44) MAOBLMNASMN1; SMN2PLK1
SCHEMBL9341512 0.81 MAOA (0.46) MAOBLMNAMAOASMN1; SMN2MAPT
SCHEMBL9342270 0.80 SMN1; SMN2 (0.46) MAOBLMNAMAOASMN1; SMN2MAPT

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 4 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
EP-0328669-A1 CHALCONE DERIVATIVE COMPOUNDS NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 — — EP disclosed
Send feedback