SCHEMBL24093571

SCHEMBL24093571

CSNc1ccccc1-c1ccc(N2CCCC2=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.53
NPC1 O15118 2/20 0.53
HPGD P15428 2/20 0.49
MEN1 O00255 1/20 0.49
LMNA P02545 1/20 0.49
KMT2A Q03164 1/20 0.49
GFER P55789 1/20 0.46
ALDH1A1 P00352 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MAPT P10636 1/20 0.42
TNIK Q9UKE5 1/20 0.41
TP53 P04637 2/20 0.40
BRD4 O60885 1/20 0.40
BRDT Q58F21 1/20 0.40
PDK2 Q15119 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL24045801 0.78 MEN1 (0.53) HPGDMEN1LMNAKMT2AGFER
SCHEMBL24093510 0.76 FPR2 (0.45)
SCHEMBL24337010 0.76 RAB9A (0.39) RAB9ANPC1HPGDMEN1LMNA
SCHEMBL26779861 0.74 ALDH1A1 (0.64) RAB9ANPC1HPGDMEN1LMNA
SCHEMBL24093648 0.73 FPR2 (0.43)
SCHEMBL11142367 0.72 ALDH1A1 (0.74) RAB9ANPC1HPGDALDH1A1CYP1A2
SCHEMBL24045765 0.71 FPR2 (0.48) HPGDLMNAGFERALDH1A1PDK2
SCHEMBL24045893 0.71 RAB9A (0.44) RAB9ANPC1HPGDMEN1LMNA
SCHEMBL136476 0.70 ALDH1A1 (0.67) RAB9ANPC1HPGDMEN1LMNA
SCHEMBL4468734 0.70 ALDH1A1 (0.57) RAB9ANPC1HPGDMEN1LMNA

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
EP-3762380-B1 PHENYLPYRROLIDINONE FORMYL PEPTIDE 2 RECEPTOR AGONISTS BRISTOL MYERS SQUIBB CO (US) 2021-12-15 EP disclosed