SCHEMBL29999825

SCHEMBL29999825

CC(C)c1ccc2cc(Br)ccc2c1N1C(=O)C=CC1=O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 4/20 0.40
▸ FAAH O00519 2/20 0.40
▸ HSP90AA1 P07900 1/20 0.34
▸ ERN1 O75460 1/20 0.34
▸ RXFP1 Q9HBX9 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CYP2A6 P11509 1/20 0.33
▸ SIRT2 Q8IXJ6 5/20 0.33
▸ NCEH1 Q6PIU2 2/20 0.33
▸ SIRT1 Q96EB6 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31

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
SCHEMBL28883367 1.00 MGLL (0.40) MGLLFAAHHSP90AA1ERN1RXFP1
SCHEMBL28958654 0.79 MGLL (0.51) MGLLFAAHHSP90AA1LMNACYP2A6
SCHEMBL28883404 0.75 MGLL (0.44) MGLLFAAH
SCHEMBL28883442 0.70 MGLL (0.44) MGLLFAAHCYP2A6KDM4EALDH1A1
SCHEMBL2032898 0.69 MGLL (0.63) MGLLFAAHHSP90AA1LMNA
SCHEMBL28883390 0.65 MGLL (0.49) MGLLFAAHHSP90AA1ALDH1A1MAPT
SCHEMBL7845940 0.64 ERN1 (0.50) HSP90AA1ERN1RXFP1CYP2A6SIRT2
SCHEMBL3675670 0.64 MGLL (0.56) MGLLFAAHHSP90AA1ALDH1A1
SCHEMBL56836 0.63 CYP2A6 (0.57) ERN1RXFP1CYP2A6NCEH1KDM4E
SCHEMBL22863431 0.63 MGLL (0.46) MGLLFAAHHSP90AA1

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
CN-115340483-A Naphthyl pyrrolindione compound, preparation method and application thereof 南京吉星生物技术开发有限公司 2022-11-15 — — CN claimed
CN-115340483-A Naphthyl pyrrolindione compound, preparation method and application thereof 南京吉星生物技术开发有限公司 2022-11-15 — — CN disclosed
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