SCHEMBL29934040

SCHEMBL29934040

Cc1ccc(C(=O)O)cc1CNc1cncc(Br)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.44
▸ HCAR2 Q8TDS4 1/20 0.44
▸ KDM4C Q9H3R0 1/20 0.44
▸ HTT P42858 6/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ PKM P14618 1/20 0.40
▸ SMN1; SMN2 Q16637 6/20 0.40
▸ MAPT P10636 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ LMNA P02545 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ PPARA Q07869 1/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ TSHR P16473 1/20 0.38

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
SCHEMBL23501594 1.00 POLB (0.44) POLBHCAR2KDM4CHTTRAB9A
SCHEMBL29933965 0.88 PKM (0.44) HTTPKMSMN1; SMN2MAPTALDH1A1
SCHEMBL23501668 0.88 PKM (0.44) HTTPKMSMN1; SMN2MAPTALDH1A1
SCHEMBL24070745 0.84 KDM4C (0.47) HCAR2KDM4CRAB9AALDH1A1KDM4E
SCHEMBL29934030 0.81 KDM4C (0.43) KDM4CPPARA
SCHEMBL28884710 0.81 KDM4C (0.43) KDM4CPPARA
SCHEMBL29933987 0.80 TAS1R3 (0.47) KDM4E
SCHEMBL29933074 0.78 ROCK2 (0.45) SMN1; SMN2ALDH1A1LMNAMAPK1
SCHEMBL23501607 0.75 HDAC8 (0.53) POLBHCAR2PKMSMN1; SMN2ALDH1A1
SCHEMBL13264471 0.75 GABRP (0.48) KDM4CSMN1; SMN2PPARA

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
CN-119371371-A Compounds and compositions as PDGF receptor kinase inhibitors 日本新药株式会社 2025-01-28 — — CN disclosed
CN-115315421-B Compounds and compositions as PDGF receptor kinase inhibitors 日本新药株式会社 2024-12-03 — — CN disclosed
CN-115315421-A Compounds and compositions as PDGF receptor kinase inhibitors 日本新药株式会社 2022-11-08 — — CN disclosed
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