SCHEMBL9341534

SCHEMBL9341534

CCc1ccc(C(=S)C=Cc2ccccc2N(C)C)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.39
▸ LMNA P02545 2/20 0.34
▸ PTGS1 P23219 2/20 0.34
▸ PTGS2 P35354 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ HDAC3 O15379 2/20 0.33
▸ HDAC4 P56524 2/20 0.33
▸ HDAC1 Q13547 2/20 0.33
▸ HDAC7 Q8WUI4 2/20 0.33
▸ HDAC2 Q92769 2/20 0.33
▸ HDAC10 Q969S8 2/20 0.33
▸ HDAC11 Q96DB2 2/20 0.33

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
SCHEMBL10497765 0.86 THRA (0.44) MEN1KMT2ATDP1
SCHEMBL9338280 0.81 SMN1; SMN2 (0.42) SMN1; SMN2LMNAPTGS1PTGS2RAB9A
SCHEMBL9337789 0.80 SMN1; SMN2 (0.45) SMN1; SMN2LMNAPTGS1PTGS2RAB9A
SCHEMBL9341673 0.78 SMN1; SMN2 (0.39) SMN1; SMN2LMNAPTGS1PTGS2RAB9A
SCHEMBL9338260 0.77 SLC16A3 (0.40) SMN1; SMN2TDP1
SCHEMBL9342531 0.77 SMN1; SMN2 (0.38) SMN1; SMN2LMNAPTGS1PTGS2RAB9A
SCHEMBL9342213 0.77 SMN1; SMN2 (0.54) SMN1; SMN2LMNAKDM4EMEN1NPC1
SCHEMBL9341961 0.76 SLC16A3 (0.41) TDP1
SCHEMBL9342565 0.76 SMN1; SMN2 (0.40) SMN1; SMN2LMNAPTGS1PTGS2RAB9A
SCHEMBL9337936 0.76 SLC16A3 (0.38) SMN1; SMN2LMNAPTGS1PTGS2HDAC3

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
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