SCHEMBL9642176

SCHEMBL9642176

CCCCCCCCCCN1C(=O)C2=CCCCC2C1=O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 7/20 0.43
▸ CNR2 P34972 4/20 0.43
▸ CNR1 P21554 1/20 0.43
▸ PTGS1 P23219 3/20 0.41
▸ PTGS2 P35354 3/20 0.41
▸ MGLL Q99685 3/20 0.41
▸ FAAH O00519 1/20 0.41
▸ CES1 P23141 2/20 0.40
▸ CDC25A P30304 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.38
▸ ALDH2 P05091 1/20 0.38
▸ ALDH3A1 P30838 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
SCHEMBL10454498 0.86 EPHX2 (0.42) ALDH1A1
SCHEMBL9630541 0.74 CYP19A1 (0.37) CYP19A1CNR2CNR1PTGS1PTGS2
SCHEMBL19751318 0.74 KMT2A (0.34) CYP19A1
SCHEMBL147206 0.74 CYP19A1 (0.36) CYP19A1CNR2CNR1PTGS1PTGS2
SCHEMBL11862292 0.70 CRBN (0.36) CYP19A1ALDH1A1
SCHEMBL11845960 0.69 CNR2 (0.46) CYP19A1CNR2CNR1PTGS1PTGS2
SCHEMBL11227276 0.68 MGLL (0.42) CYP19A1CNR2CNR1PTGS1PTGS2
SCHEMBL9862131 0.67 MAPT (0.31) —
SCHEMBL7482405 0.67 PTGS1 (0.52) CYP19A1CNR2CNR1PTGS1PTGS2
SCHEMBL7481753 0.67 PTGS1 (0.52) CYP19A1CNR2CNR1PTGS1PTGS2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0253553-B1 PHOTOLYTICALLY CROSSLINKABLE THERMALLY STABLE COMPOSITION THE DOW CHEMICAL COMPANY (US) 1992-10-07 — — EP claimed
EP-0253553-A1 Photolytically crosslinkable thermally stable composition THE DOW CHEMICAL COMPANY (US) 1988-01-20 — — EP claimed
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