SCHEMBL24819952

SCHEMBL24819952

Cn1cnnc1-c1ccccc1-c1cccc(Br)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 4/20 0.40
GABRB3 P28472 4/20 0.40
GABRA5 P31644 4/20 0.40
GABRA3 P34903 4/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
GABRA1 P14867 3/20 0.40
PIM1 P11309 1/20 0.40
MAOB P27338 1/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
MAPT P10636 3/20 0.39
KDM4E B2RXH2 4/20 0.39
NPSR1 Q6W5P4 2/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 4/20 0.39
HPGD P15428 2/20 0.39

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
SCHEMBL30999280 1.00 GABRG2 (0.40) GABRG2GABRB3GABRA5GABRA3MEN1
SCHEMBL29920328 0.85 GAA (0.39) GABRG2GABRB3GABRA5GABRA3MEN1
SCHEMBL30792272 0.84 ALDH1A1 (0.49) PIM1NPC1RAB9ASMN1; SMN2TSHR
SCHEMBL29193077 0.82 KDM4E (0.40) GABRG2GABRB3GABRA5GABRA3MEN1
SCHEMBL24820283 0.82 IDO1 (0.47) MEN1KMT2AMAOBNPC1RAB9A
SCHEMBL24819955 0.82 BRD4 (0.47) RAB9ATSHRKDM4EALDH1A1HPGD
SCHEMBL29920482 0.82 BRD4 (0.47) RAB9ATSHRKDM4EALDH1A1HPGD
SCHEMBL27085998 0.82 KDM4E (0.42) GABRG2GABRB3GABRA5GABRA3MEN1
SCHEMBL24818871 0.80 CBLB (0.52) GABRG2GABRB3GABRA5GABRA3MEN1
SCHEMBL30825379 0.80 BRD4 (0.39) GABRG2GABRB3GABRA5MEN1KMT2A

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-2022272248-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-12-29 WO disclosed