SCHEMBL26654802

SCHEMBL26654802

COc1c(Br)ccc(NC2CC2)c1N

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.35
ALOX15 P16050 2/20 0.34
YAP1 P46937 1/20 0.34
MAPT P10636 6/20 0.33
KDM4E B2RXH2 2/20 0.33
MBOAT4 Q96T53 1/20 0.33
GAA P10253 1/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
POLB P06746 2/20 0.32
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
KMT2A Q03164 1/20 0.32
NQO2 P16083 1/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 2/20 0.31
ROCK2 O75116 1/20 0.31
HTR3E A5X5Y0 1/20 0.31
HTR3B O95264 1/20 0.31
CHRM4 P08173 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
SCHEMBL26654532 0.90 FYN (0.37) PTGER4MAPTPOLB
SCHEMBL26655136 0.86 ALOX5AP (0.31) PTGER4ALOX15MAPTMBOAT4ALOX5AP
SCHEMBL26654487 0.84 PDE1B (0.35)
SCHEMBL29818977 0.80 PTGER4 (0.38) PTGER4ALOX15YAP1MAPTKDM4E
SCHEMBL21713733 0.80 PTGER4 (0.38) PTGER4ALOX15YAP1MAPTKDM4E
SCHEMBL26654848 0.78 ALOX5AP (0.36) ALOX15MAPTKDM4EALOX5APFEN1
SCHEMBL26654782 0.76 MAPT (0.43) PTGER4MAPTGAAPOLBMEN1
SCHEMBL26655014 0.73 PTGER4 (0.36) PTGER4ALOX15MAPTKDM4EGAA
SCHEMBL24344353 0.71 ALOX5AP (0.39) ALOX15MAPTKDM4EALOX5APFEN1
SCHEMBL1519286 0.69 ALOX5AP (0.40) ALOX15MAPTALOX5APFEN1POLB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4524139-A1 IMIDAZOPYRIDAZINE SUBSTITUTED BENZENE RING DERIVATIVE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE Shanghai Simr Biotechnology Co., Ltd. (CN) 2025-03-19 EP disclosed
CN-117069725-A Imidazopyridazine substituted benzene ring derivative, preparation method, pharmaceutical composition and application 上海赛默罗生物科技有限公司 2023-11-17 CN disclosed
WO-2023216753-A1 IMIDAZOPYRIDAZINE SUBSTITUTED BENZENE RING DERIVATIVE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE 上海赛默罗生物科技有限公司 2023-11-16 WO disclosed