SCHEMBL9341673

SCHEMBL9341673

CCCc1ccccc1C=CC(=S)c1ccc(CC)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ PTGER3 P43115 5/20 0.36
▸ PTGER2 P43116 5/20 0.36
▸ TBXA2R P21731 3/20 0.36
▸ PTGDR Q13258 3/20 0.36
▸ PTGS1 P23219 2/20 0.34
▸ PTGS2 P35354 2/20 0.34
▸ SLC16A3 O15427 1/20 0.34
▸ PTGER4 P35408 4/20 0.34
▸ PTGFR P43088 2/20 0.34
▸ HDAC3 O15379 3/20 0.34
▸ HDAC4 P56524 3/20 0.34
▸ HDAC1 Q13547 3/20 0.34
▸ HDAC7 Q8WUI4 3/20 0.34
▸ HDAC2 Q92769 3/20 0.34
▸ HDAC10 Q969S8 3/20 0.34
▸ HDAC11 Q96DB2 3/20 0.34
▸ HDAC8 Q9BY41 3/20 0.34
▸ HDAC6 Q9UBN7 3/20 0.34
▸ HDAC9 Q9UKV0 3/20 0.34

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
SCHEMBL9337936 0.92 SLC16A3 (0.38) SMN1; SMN2PTGER3PTGER2TBXA2RPTGDR
SCHEMBL9338260 0.91 SLC16A3 (0.40) SMN1; SMN2SLC16A3THRB
SCHEMBL9338280 0.90 SMN1; SMN2 (0.42) SMN1; SMN2PTGER3PTGER2TBXA2RPTGDR
SCHEMBL9341961 0.90 SLC16A3 (0.41) SLC16A3THRB
SCHEMBL10585548 0.88 PTGER3 (0.37) SMN1; SMN2PTGER3PTGER2TBXA2RPTGDR
SCHEMBL9338419 0.88 SMN1; SMN2 (0.36) SMN1; SMN2PTGS1PTGS2SLC16A3HDAC3
SCHEMBL10497772 0.87 THRA (0.45) KMT2ATHRB
SCHEMBL9339850 0.85 SMN1; SMN2 (0.38) SMN1; SMN2PTGS1PTGS2MAOAALDH1A1
SCHEMBL9778593 0.84 PTGS2 (0.38) SMN1; SMN2PTGER3PTGER2TBXA2RPTGDR
SCHEMBL10497563 0.82 THRA (0.45) KMT2ATHRB

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
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
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