SCHEMBL29407748

SCHEMBL29407748

Cn1c(Br)c(C2CCN(C(=O)OC(C)(C)C)CC2)c2c(N)ncnc21

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 5/20 0.49
▸ EGFR P00533 3/20 0.49
▸ ABL1 P00519 2/20 0.45
▸ ABL2 P42684 2/20 0.45
▸ TGFBR1 P36897 2/20 0.44
▸ PIK3CD O00329 5/20 0.43
▸ MAP4K4 O95819 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ GPR119 Q8TDV5 1/20 0.41
▸ LRRK2 Q5S007 1/20 0.41

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
SCHEMBL22658825 1.00 SRC (0.49) SRCEGFRABL1ABL2TGFBR1
SCHEMBL28685316 0.85 DYRK1A (0.44) SRCEGFRMAP4K4LRRK2
SCHEMBL22658694 0.83 LRRK2 (0.43) EGFRLRRK2
SCHEMBL29407749 0.83 LRRK2 (0.43) EGFRLRRK2
SCHEMBL29407628 0.83 SRC (0.52) SRCEGFRABL1ABL2TGFBR1
SCHEMBL22658709 0.83 SRC (0.52) SRCEGFRABL1ABL2TGFBR1
SCHEMBL22676717 0.79 SRC (0.52) SRCEGFRABL1ABL2TGFBR1
SCHEMBL22677043 0.77 F13A1 (0.45) SRCEGFRABL1ABL2TGFBR1
SCHEMBL869280 0.76 SRC (0.64) SRCEGFRABL1ABL2TGFBR1
SCHEMBL19476297 0.76 JAK2 (0.66) SRCEGFRABL1ABL2TGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119874707-A FGFR inhibitors and methods of use thereof 传达治疗有限公司 2025-04-25 — — CN disclosed
CN-114126620-B FGFR inhibitors and methods of use thereof 传达治疗有限公司 2024-12-31 — — CN disclosed
EP-3968999-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF Relay Therapeutics, Inc. (US) 2022-03-23 — — EP disclosed
CN-114126620-A FGFR inhibitors and methods of use thereof 传达治疗有限公司 2022-03-01 — — CN disclosed
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