SCHEMBL31264694

SCHEMBL31264694

Cn1c(I)c(-c2ccc(Oc3ccc(Cl)cn3)c(F)c2)c2c(N)ncnc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2C9 P11712 2/20 0.42
▸ CYP2C19 P33261 2/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ FGFR1 P11362 1/20 0.42
▸ FGFR2 P21802 1/20 0.42
▸ FGFR4 P22455 1/20 0.42
▸ FGFR3 P22607 1/20 0.42
▸ MAP4K4 O95819 1/20 0.37
▸ PIK3CD O00329 9/20 0.36
▸ SRC P12931 6/20 0.36
▸ KDR P35968 6/20 0.36
▸ ABL1 P00519 5/20 0.36
▸ EGFR P00533 5/20 0.36
▸ HCK P08631 5/20 0.36
▸ PIK3CA P42336 4/20 0.36
▸ PIK3CB P42338 4/20 0.36
▸ MTOR P42345 4/20 0.36
▸ PIK3CG P48736 4/20 0.36
▸ EPHB4 P54760 4/20 0.36

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
SCHEMBL31264634 0.85 CYP3A4 (0.43) CYP2C9CYP2C19CYP3A4CYP2D6FGFR1
SCHEMBL31264736 0.81 EIF2AK3 (0.44) SRCKDRLCKTEKRIPK2
SCHEMBL22658735 0.79 CYP3A4 (0.64) CYP2C9CYP2C19CYP3A4CYP2D6FGFR1
SCHEMBL31264707 0.77 CYP3A4 (0.43) CYP2C9CYP2C19CYP3A4CYP2D6FGFR1
SCHEMBL31264720 0.76 CYP3A4 (0.51) CYP2C9CYP2C19CYP3A4CYP2D6FGFR1
SCHEMBL31264741 0.76 CYP3A4 (0.51) CYP2C9CYP2C19CYP3A4CYP2D6FGFR1
SCHEMBL31264680 0.76 FGFR1 (0.60) CYP2C9CYP2C19CYP3A4CYP2D6FGFR1
SCHEMBL24458871 0.75 RET (0.47) PIK3CDSRCKDRABL1EGFR
SCHEMBL31264711 0.73 FGFR1 (0.43) CYP2C9CYP2C19CYP3A4CYP2D6FGFR1
SCHEMBL31264649 0.73 FGFR1 (0.43) CYP2C9CYP2C19CYP3A4CYP2D6FGFR1

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
EP-4722216-A1 PYRROLOPYRIMIDINE DERIVATIVE AND USE THEREOF IN MEDICINE Kangbaida (Sichuan) Biotechnology Co., Ltd. (CN) 2026-04-08 — — EP disclosed
CN-119894900-A Pyrrolo pyrimidine derivative and application thereof in medicine 康百达(四川)生物医药科技有限公司 2025-04-25 — — CN disclosed
WO-2024251147-A1 PYRROLOPYRIMIDINE DERIVATIVE AND USE THEREOF IN MEDICINE 康百达(四川)生物医药科技有限公司 2024-12-12 — — WO disclosed
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