SCHEMBL30348704

SCHEMBL30348704

Cc1nc2ccc(-c3c[nH]c4nc(NC5CCC(F)(F)CC5)ncc34)cc2s1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 2/20 0.39
▸ ROCK2 O75116 1/20 0.38
▸ DYRK2 Q92630 6/20 0.38
▸ ABL1 P00519 4/20 0.37
▸ IDH1 O75874 1/20 0.36
▸ DYRK1A Q13627 2/20 0.35
▸ CLK2 P49760 1/20 0.35
▸ CLK3 P49761 1/20 0.35
▸ CCNT1 O60563 1/20 0.35
▸ CCNK O75909 1/20 0.35
▸ CCNE1 P24864 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ CDK7 P50613 1/20 0.35
▸ CDK9 P50750 1/20 0.35
▸ CCNH P51946 1/20 0.35
▸ MNAT1 P51948 1/20 0.35
▸ CDK12 Q9NYV4 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ MAPK10 P53779 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35

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
SCHEMBL25157917 1.00 BRD4 (0.39) BRD4ROCK2DYRK2ABL1IDH1
SCHEMBL25158432 0.91 ABL1 (0.40) BRD4ROCK2DYRK2ABL1DYRK1A
SCHEMBL30347640 0.91 ABL1 (0.40) BRD4ROCK2DYRK2ABL1DYRK1A
SCHEMBL25158434 0.89 CDC7 (0.42) BRD4ROCK2ABL1DYRK1ACLK2
SCHEMBL25158420 0.87 DYRK1A (0.44) BRD4ROCK2ABL1DYRK1ACLK2
SCHEMBL30348489 0.87 DYRK1A (0.44) BRD4ROCK2ABL1DYRK1ACLK2
SCHEMBL30348056 0.87 BRD4 (0.38) BRD4DYRK2ABL1DYRK1ACLK2
SCHEMBL25518089 0.87 BRD4 (0.38) BRD4DYRK2ABL1DYRK1ACLK2
SCHEMBL30348692 0.86 DYRK1A (0.47) BRD4ROCK2DYRK2ABL1DYRK1A
SCHEMBL25158417 0.86 DYRK1A (0.47) BRD4ROCK2DYRK2ABL1DYRK1A

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-4415818-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AS DYRK1A INHIBITORS BioSplice Therapeutics, Inc. (US) 2024-08-21 — — EP claimed
WO-2023064361-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AS DYRK1A INHIBITORS BIOSPLICE THERAPEUTICS, INC. (US) 2023-04-20 — — WO claimed
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