SCHEMBL9341895

SCHEMBL9341895

Cc1ccc(C(=S)C=Cc2ccc(O)c(O)c2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 2/20 0.55
▸ MMP2 P08253 2/20 0.55
▸ MMP9 P14780 2/20 0.55
▸ MAPT P10636 2/20 0.53
▸ TERT O14746 1/20 0.53
▸ SNCA P37840 1/20 0.53
▸ IAPP P10997 1/20 0.51
▸ PTGS1 P23219 1/20 0.51
▸ LCK P06239 1/20 0.50
▸ CXCL12 P48061 1/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ HSD17B10 Q99714 2/20 0.49
▸ TTR P02766 2/20 0.49
▸ DPP4 P27487 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ HDAC3 O15379 1/20 0.49
▸ CA12 O43570 1/20 0.49
▸ AKR1B10 O60218 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ CA1 P00915 1/20 0.49

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
SCHEMBL9339700 0.85 PTGS1 (0.43) MMP1MMP2MMP9MAPTPTGS1
SCHEMBL10337730 0.84 MAPT (0.60) MAPTMEN1ALDH1A1CA1LMNA
SCHEMBL9338179 0.81 MAPT (0.65) MMP1MMP2MMP9MAPTDPP4
SCHEMBL25265529 0.81 MAPT (0.76) MAPTTERTSNCACXCL12POLB
SCHEMBL23951571 0.81 MAPT (0.76) MAPTTERTSNCACXCL12POLB
SCHEMBL9339719 0.79 PTGS2 (0.49) MAPTCXCL12CYP3A4TDP1
SCHEMBL9338041 0.79 NFE2L2 (0.62) MAPTCXCL12ALDH1A1POLBCYP3A4
SCHEMBL9337604 0.79 MMP1 (0.56) MMP1MMP2MMP9MAPTLCK
SCHEMBL9340999 0.79 MAPT (0.44) MAPTCXCL12ALDH1A1LMNAPOLB
SCHEMBL9338474 0.79 MAPT (0.44) MAPTCXCL12ALDH1A1CA1CA2

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