SCHEMBL24196176

SCHEMBL24196176

Cc1c(C(=O)C2CC2)[nH]c2ccc(F)cc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.45
KEAP1 Q14145 1/20 0.44
NFE2L2 Q16236 1/20 0.44
MAP2 P11137 1/20 0.43
BRD3 Q15059 1/20 0.43
CFD P00746 1/20 0.42
ALDH1A1 P00352 3/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
POLB P06746 1/20 0.42
PKM P14618 1/20 0.42
NPY1R P25929 1/20 0.42
NPY2R P49146 1/20 0.42
MAPT P10636 3/20 0.41
KDM4E B2RXH2 2/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KIF11 P52732 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
EGFR P00533 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
SCHEMBL24196174 0.83 MAP2 (0.43) KEAP1NFE2L2MAP2BRD3CFD
SCHEMBL2730323 0.82 ALDH1A1 (0.59) CNR1KEAP1NFE2L2MAP2CFD
SCHEMBL24196832 0.81 MAP2 (0.41) KEAP1NFE2L2MAP2BRD3CFD
SCHEMBL24196991 0.79 CNR1 (0.52) CNR1KEAP1NFE2L2MAP2ALDH1A1
SCHEMBL2730512 0.79 MAP2 (0.61) CNR1KEAP1NFE2L2MAP2ALDH1A1
SCHEMBL24196180 0.75 GABRA1 (0.56) CNR1KEAP1NFE2L2MAP2ALDH1A1
SCHEMBL24196942 0.75 PTGS2 (0.59) CNR1ALDH1A1KMT2AMEN1POLB
SCHEMBL3283431 0.74 ALDH1A1 (0.69) CNR1ALDH1A1KMT2AMEN1POLB
SCHEMBL24196994 0.73 CNR1 (0.47) CNR1KEAP1NFE2L2MAP2ALDH1A1
SCHEMBL24196586 0.72 GABRA1 (0.50) CNR1KEAP1NFE2L2MAP2ALDH1A1

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
WO-2022008475-A1 INDOLE DERIVATIVES AND USES THEREOF FOR TREATING A CANCER UNIVERSITE CLAUDE BERNARD LYON 1 (FR) 2022-01-13 WO disclosed