SCHEMBL29276697

SCHEMBL29276697

CSc1ccc(Cn2cc(N)cn2)cc1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.62
▸ MAPT P10636 2/20 0.62
▸ KMT2A Q03164 2/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ ALDH1A1 P00352 3/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ PKM P14618 1/20 0.45
▸ SLC6A4 P31645 2/20 0.40
▸ MAOA P21397 1/20 0.39
▸ SLC6A2 P23975 1/20 0.39
▸ SLC6A3 Q01959 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ KLKB1 P03952 2/20 0.37
▸ F2R P25116 1/20 0.37

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
SCHEMBL3593783 0.81 MAPT (0.68) LMNAMAPTKMT2AMEN1ALDH1A1
SCHEMBL19268474 0.81 MAPT (0.68) LMNAMAPTKMT2AMEN1ALDH1A1
SCHEMBL712713 0.80 MAPT (0.70) LMNAMAPTKMT2AMEN1ALDH1A1
SCHEMBL2822506 0.79 HSD17B10 (0.40) LMNAMAPTKMT2AMEN1ALDH1A1
SCHEMBL3611556 0.78 MAPT (0.97) LMNAMAPTKMT2AMEN1ALDH1A1
Hydrochloric Acid SCHEMBL712415 0.78 MAPT (0.73) LMNAMAPTKMT2AMEN1ALDH1A1
SCHEMBL950986 0.78 MAPT (0.67) LMNAMAPTKMT2AMEN1ALDH1A1
SCHEMBL165409 0.77 MEN1 (0.69) LMNAMAPTKMT2AMEN1ALDH1A1
Hydrochloric Acid SCHEMBL4500305 0.77 MAPT (1.00) LMNAMAPTKMT2AMEN1ALDH1A1
SCHEMBL1979091 0.76 MAPT (0.65) LMNAMAPTKMT2AMEN1ALDH1A1

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-119451961-A Carboxamide derivative with RSK inhibition effect, pharmaceutical composition containing carboxamide derivative and application of carboxamide derivative 广州科恩泰生物医药科技有限公司 2025-02-14 — — CN disclosed
WO-2023236960-A1 CARBOXAMIDE DERIVATIVE HAVING RSK INHIBITORY EFFECT, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF 上海科恩泰生物医药科技有限公司 2023-12-14 — — WO disclosed
CN-117186098-A Carboxamide derivative with RSK inhibition effect, pharmaceutical composition containing carboxamide derivative and application of carboxamide derivative 上海科恩泰生物医药科技有限公司 2023-12-08 — — CN disclosed
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