SCHEMBL30767260

SCHEMBL30767260

C[C@@H]1CN(c2ccc(-c3n[nH]c4cnc(N5[C@H](C)CNC[C@@H]5C)nc34)cn2)CCN1C

nearest known ligand 0.79

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ACVR1 Q04771 17/20 0.79
▸ FGFR1 P11362 12/20 0.74
▸ FGFR2 P21802 12/20 0.74
▸ FGFR3 P22607 10/20 0.64
▸ BMPR1A P36894 3/20 0.64
▸ TGFBR1 P36897 3/20 0.64
▸ ACVRL1 P37023 3/20 0.64
▸ HAMP P81172 3/20 0.64

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
SCHEMBL30767254 0.91 ACVR1 (0.75) ACVR1FGFR1FGFR2FGFR3BMPR1A
SCHEMBL30767262 0.88 ACVR1 (1.00) ACVR1FGFR1FGFR2FGFR3BMPR1A
SCHEMBL21808329 0.88 FGFR2 (0.83) ACVR1FGFR1FGFR2FGFR3BMPR1A
SCHEMBL21808358 0.88 FGFR2 (0.83) ACVR1FGFR1FGFR2FGFR3BMPR1A
SCHEMBL30767263 0.86 ACVR1 (0.75) ACVR1FGFR1FGFR2FGFR3BMPR1A
SCHEMBL21846789 0.85 FGFR2 (1.00) ACVR1FGFR1FGFR2FGFR3BMPR1A
SCHEMBL21891835 0.85 FGFR2 (1.00) ACVR1FGFR1FGFR2FGFR3BMPR1A
SCHEMBL30433663 0.85 FGFR2 (1.00) ACVR1FGFR1FGFR2FGFR3BMPR1A
SCHEMBL21891829 0.84 ACVR1 (0.66) ACVR1FGFR1FGFR2FGFR3BMPR1A
SCHEMBL30767266 0.81 ACVR1 (0.82) ACVR1FGFR1FGFR2FGFR3BMPR1A

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
EP-3856348-B1 PYRAZOLO[4,3-D]PYRIMIDINE COMPOUNDS AS ALK2 AND/OR FGFR MODULATORS INCYTE CORP (US) 2024-01-03 — — EP claimed
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