SCHEMBL30569445

SCHEMBL30569445

Cc1oc2ccc(OCc3ccccc3)c([C@H]3CC[C@@H](N)CC3)c2c1C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
EDNRA P25101 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
IRAK1 P51617 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.39
TRPM8 Q7Z2W7 4/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
CA9 Q16790 1/20 0.38
KDM1A O60341 2/20 0.38
F2 P00734 2/20 0.38
MAOB P27338 2/20 0.38
MAOA P21397 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL30569472 1.00 CASP3 (0.46) CASP3SENP8SENP7SENP6EDNRA
SCHEMBL29104623 1.00 CASP3 (0.46) CASP3SENP8SENP7SENP6EDNRA
SCHEMBL29104665 1.00 CASP3 (0.46) CASP3SENP8SENP7SENP6EDNRA
SCHEMBL29104663 0.87 CASP3 (0.44) CASP3SENP8SENP7SENP6EDNRA
SCHEMBL30569463 0.87 CASP3 (0.44) CASP3SENP8SENP7SENP6EDNRA
SCHEMBL29104701 0.85 HTR1A (0.47) CASP3SENP8SENP7SENP6EDNRA
SCHEMBL30569425 0.85 HTR1A (0.47) CASP3SENP8SENP7SENP6EDNRA
SCHEMBL29104673 0.78 CASP3 (0.48) CASP3SENP8SENP7SENP6EDNRA
SCHEMBL30569377 0.78 CASP3 (0.48) CASP3SENP8SENP7SENP6EDNRA
SCHEMBL24470877 0.72 CASP3 (0.54) CASP3SENP8SENP7SENP6EDNRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116761796-A Aryl derivatives for the treatment of TRPM3 mediated disorders 勒芬天主教大学 2023-09-15 CN disclosed