SCHEMBL8414824

SCHEMBL8414824

CON(C)C(=O)[C@](C)(c1ccccc1)[C@@H](N)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
KCNN4 O15554 1/20 0.38
KIF11 P52732 8/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
AOC3 Q16853 1/20 0.35
CES1 P23141 1/20 0.35
DRD4 P21917 1/20 0.35
OPRM1 P35372 1/20 0.35
DRD3 P35462 1/20 0.35
CYP2C19 P33261 1/20 0.34
HIF1A Q16665 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ALOX15 P16050 1/20 0.33

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
SCHEMBL343793 0.77 KMT2A (0.50) MAPTKMT2AKCNN4CES1DRD4
SCHEMBL8413139 0.73 POLB (0.44) MAPTKMT2ACYP2D6CYP2C19CHRM2
SCHEMBL1666946 0.66 CYP1A2 (0.53) MAPTKMT2AKCNN4KIF11CYP1A2
SCHEMBL13357533 0.66 KMT2A (0.43) KMT2ACYP1A2CYP2D6AOC3HIF1A
SCHEMBL8879105 0.66 KMT2A (0.43) KMT2ACYP1A2CYP2D6AOC3HIF1A
SCHEMBL18493201 0.66 MAPT (0.53) MAPTKMT2AKCNN4KIF11CYP1A2
SCHEMBL28393924 0.65 CYP1A2 (0.47) MAPTKMT2AKCNN4KIF11CYP1A2
SCHEMBL60359 0.65 CYP1A2 (0.52) MAPTKMT2AKCNN4KIF11CYP1A2
SCHEMBL25007307 0.65 PTPN5 (0.48) KIF11AOC3
SCHEMBL30222787 0.65 PTPN5 (0.48) KIF11AOC3

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
US-5952322-A AMIDE-SUBSTITUTED BENZIMIDAZOLE, INDOLE DERIVATIVES PFIZER INC. (US) 1999-09-14 US disclosed