SCHEMBL9368665

SCHEMBL9368665

CCOC(=O)CN(Cc1ccccc1)C(=O)Cc1c(C)cc(C)cc1C

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PIN1 Q13526 1/20 0.47
▸ TRPM8 Q7Z2W7 1/20 0.44
▸ TSPO P30536 2/20 0.44
▸ ALDH1A1 P00352 5/20 0.44
▸ TSHR P16473 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ LMNA P02545 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ TEAD1 P28347 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ ATM Q13315 1/20 0.41

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
SCHEMBL9372436 0.82 NLRP3 (0.43) TSPOALDH1A1LMNAL3MBTL1SMN1; SMN2
SCHEMBL3213534 0.82 ALDH1A1 (0.55) PIN1TRPM8TSPOALDH1A1TSHR
SCHEMBL5941081 0.82 PIN1 (0.56) PIN1TRPM8ALDH1A1TSHRMAPK1
SCHEMBL691909 0.81 SMN1; SMN2 (0.56) PIN1TRPM8ALDH1A1TSHRMAPK1
SCHEMBL9686760 0.81 PIN1 (0.53) PIN1TRPM8ALDH1A1TSHRMAPK1
SCHEMBL3211799 0.80 PIN1 (0.52) PIN1TRPM8ALDH1A1TSHRMAPK1
SCHEMBL3213531 0.80 PIN1 (0.52) PIN1TRPM8ALDH1A1TSHRMAPK1
SCHEMBL4433228 0.80 PIN1 (0.52) PIN1TRPM8ALDH1A1TSHRMAPK1
SCHEMBL15173708 0.79 PIN1 (0.54) PIN1TRPM8ALDH1A1TSHRMAPK1
SCHEMBL15173707 0.78 PIN1 (0.53) PIN1TRPM8ALDH1A1TSHRMAPK1

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-0377893-B1 3-Aryl-pyrrolidine-2,4-dione derivatives BAYER AG (DE) 1994-04-06 — — EP disclosed
US-5186737-A Herbicides BAYER AKTIENGESELLSCHAFT (DE) 1993-02-16 — — US disclosed
US-5045560-A Insecticides, nematocides, fungicides, herbicides, human and veterinary medicine BAYER AKTIENGESELLSCHAFT (DE) 1991-09-03 — — US disclosed
EP-0377893-A2 3-Aryl-pyrrolidine-2,4-dione derivatives BAYER AG (DE) 1990-07-18 — — EP disclosed
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