SCHEMBL21252169

SCHEMBL21252169

COc1cc(OC)c(Cl)c(-c2cc3cnc(N)nc3c(N3CCC(OC)C3)n2)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 4/20 0.38
▸ PDE10A Q9Y233 3/20 0.37
▸ PDE3B Q13370 2/20 0.37
▸ PDE3A Q14432 2/20 0.37
▸ NEK2 P51955 4/20 0.36
▸ TTK P33981 2/20 0.36
▸ FGFR2 P21802 2/20 0.35
▸ MAP3K12 Q12852 1/20 0.35
▸ SUV39H2 Q9H5I1 1/20 0.34
▸ MAP4K4 O95819 1/20 0.34

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
SCHEMBL24488354 0.94 MAP4K4 (0.39) FGFR1NEK2TTKFGFR2MAP3K12
SCHEMBL21251649 0.92 FGFR1 (0.38) FGFR1TTKFGFR2MAP3K12
SCHEMBL21252280 0.89 TTK (0.38) PDE10APDE3BPDE3ANEK2TTK
SCHEMBL21252066 0.88 FGFR1 (0.37) FGFR1NEK2TTKFGFR2
SCHEMBL21252253 0.88 TTK (0.38) FGFR1NEK2TTKFGFR2MAP3K12
SCHEMBL20331964 0.87 PDE10A (0.36) PDE10APDE3BPDE3ANEK2TTK
SCHEMBL29578107 0.87 PDE10A (0.36) PDE10APDE3BPDE3ANEK2TTK
SCHEMBL21252525 0.86 FGFR1 (0.36) FGFR1TTKFGFR2MAP3K12
SCHEMBL21252444 0.86 NEK2 (0.39) FGFR1NEK2FGFR2SUV39H2
SCHEMBL21252449 0.86 TTK (0.38) FGFR1NEK2TTKFGFR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3524603-B1 FGFR4 INHIBITOR, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF ABBISKO THERAPEUTICS CO LTD (CN) 2022-06-08 — — EP disclosed
EP-3524603-A1 FGFR4 INHIBITOR, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF Abbisko Therapeutics Co., Ltd. (CN) 2019-08-14 — — EP disclosed
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