SCHEMBL23302179

SCHEMBL23302179

Cc1nc2cc(Br)c(C(F)(F)F)cc2n1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ CHRNB2 P17787 1/20 0.42
▸ CHRNA4 P43681 1/20 0.42
▸ MAPT P10636 3/20 0.38
▸ ESRRA P11474 1/20 0.37
▸ HSD11B1 P28845 2/20 0.37
▸ HDAC1 Q13547 1/20 0.35
▸ NPC1 O15118 5/20 0.35
▸ RAB9A P51151 5/20 0.35
▸ PDGFRB P09619 1/20 0.34
▸ KIT P10721 1/20 0.34
▸ FLT3 P36888 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ IRAK4 Q9NWZ3 1/20 0.34
▸ ATM Q13315 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 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
SCHEMBL28392846 0.81 KDM4E (0.58) KDM4EALDH1A1LMNACHRNB2CHRNA4
SCHEMBL24978830 0.81 KDM4E (0.47) KDM4EALDH1A1LMNACHRNB2CHRNA4
SCHEMBL16806050 0.81 KDM4E (0.47) KDM4EALDH1A1LMNACHRNB2CHRNA4
SCHEMBL23302121 0.80 GRM2 (0.35) HSD11B1NPC1RAB9AIRAK4MEN1
SCHEMBL16806047 0.78 KDM4E (0.51) KDM4EALDH1A1LMNACHRNB2CHRNA4
SCHEMBL29896863 0.77 RAB9A (0.39) ALDH1A1LMNAMAPTESRRANPC1
SCHEMBL12763859 0.77 RAB9A (0.39) ALDH1A1LMNAMAPTESRRANPC1
SCHEMBL23302246 0.75 KDM4E (0.51) KDM4EALDH1A1LMNACHRNB2CHRNA4
SCHEMBL13916682 0.74 KDM4E (0.69) KDM4EALDH1A1LMNACHRNB2CHRNA4
SCHEMBL13916685 0.72 KDM4E (0.67) KDM4EALDH1A1LMNACHRNB2CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025092986-A1 POLYCYCLIC COMPOUND, PREPARATION METHODS AND MEDICINAL USES THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2025-05-08 — — WO disclosed
CN-119424423-A 4-Aminobut-2-enamide derivatives and salts thereof 大鹏药品工业株式会社 2025-02-14 — — CN disclosed
CN-115551500-A 4-aminobut-2-enamide derivatives and salts thereof 大鹏药品工业株式会社 2022-12-30 — — CN disclosed
EP-4051266-A1 4-AMINOBUT-2-ENAMIDE DERIVATIVES AND SALTS THEREOF Taiho Pharmaceutical Co., Ltd. (JP) 2022-09-07 — — EP disclosed
WO-2021084765-A1 4-AMINOBUT-2-ENAMIDE DERIVATIVES AND SALTS THEREOF TAIHO PHARMACEUTICAL CO., LTD (JP) 2021-05-06 — — WO disclosed
WO-2021085653-A1 4-AMINOBUT-2-ENAMIDE DERIVATIVES AND SALTS THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 2021-05-06 — — WO disclosed
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