SCHEMBL20331865

SCHEMBL20331865

COc1cc(OC)c(F)c(-c2cc3cnc(N)cc3c(N3CCC(OC)C3)n2)c1F

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 10/20 0.37
▸ PDE3B Q13370 9/20 0.37
▸ PDE3A Q14432 9/20 0.37
▸ MAP3K12 Q12852 2/20 0.37
▸ NTSR1 P30989 3/20 0.35
▸ NEK2 P51955 4/20 0.35
▸ ACACB O00763 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
SCHEMBL21252174 0.94 PIK3CA (0.37) NTSR1NEK2
SCHEMBL21252083 0.92 PDE10A (0.34) PDE10AMAP3K12
SCHEMBL20332232 0.89 PDE10A (0.37) PDE10APDE3BPDE3ANTSR1ACACB
SCHEMBL21240363 0.89 PDE10A (0.39) PDE10APDE3BPDE3ANTSR1ACACB
SCHEMBL24488230 0.89 PDE10A (0.39) PDE10APDE3BPDE3AMAP3K12NTSR1
SCHEMBL20332035 0.85 PDE10A (0.37) PDE10APDE3BPDE3AMAP3K12NTSR1
SCHEMBL21252280 0.85 TTK (0.38) PDE10APDE3BPDE3AMAP3K12NEK2
SCHEMBL21252027 0.84 PDE10A (0.40) PDE10APDE3BPDE3ANTSR1
SCHEMBL21252087 0.83 MAP4K4 (0.39) PDE10APDE3BPDE3AMAP3K12
SCHEMBL21252468 0.83 LRRK2 (0.42) PDE10AMAP3K12

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-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
WO-2018113584-A1 FGFR4 INHIBITOR, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF 上海和誉生物医药科技有限公司 2018-06-28 — — WO disclosed
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