SCHEMBL9338126

SCHEMBL9338126

CCCCOc1ccccc1C=CC(=S)c1ccc(CCC)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ PTGES O14684 2/20 0.39
▸ ALOX5 P09917 2/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ AR P10275 1/20 0.38
▸ AKR1C3 P42330 1/20 0.38
▸ PTGER1 P34995 1/20 0.38
▸ PTGER4 P35408 1/20 0.38
▸ PTGER3 P43115 1/20 0.38

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
SCHEMBL9339766 0.96 LMNA (0.42) SMN1; SMN2LMNAMAPTATMPTGES
SCHEMBL9338690 0.95 LMNA (0.41) SMN1; SMN2LMNAMAPTATMPTGES
SCHEMBL9338443 0.95 LMNA (0.41) SMN1; SMN2LMNAMAPTATMPTGES
SCHEMBL9338152 0.95 LMNA (0.41) SMN1; SMN2LMNAMAPTATMPTGES
SCHEMBL9342044 0.95 LMNA (0.41) SMN1; SMN2LMNAMAPTATMPTGES
SCHEMBL9341391 0.95 LMNA (0.41) SMN1; SMN2LMNAMAPTATMPTGES
SCHEMBL9337765 0.95 LMNA (0.41) SMN1; SMN2LMNAMAPTATMPTGES
SCHEMBL9338184 0.95 LMNA (0.41) SMN1; SMN2LMNAMAPTATMPTGES
SCHEMBL9341570 0.95 LMNA (0.41) SMN1; SMN2LMNAMAPTATMPTGES
SCHEMBL9339727 0.95 LMNA (0.41) SMN1; SMN2LMNAMAPTATMPTGES

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
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