SCHEMBL24791684

SCHEMBL24791684

c1ccc(-c2ccc(CNc3cc(NC4CCNC4)nc4c(C5CC5)cnn34)cc2)nc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 8/20 0.45
▸ CCNA2 P20248 3/20 0.45
▸ CHEK1 O14757 2/20 0.45
▸ CCNA1 P78396 2/20 0.45
▸ CDK7 P50613 6/20 0.44
▸ CCNE1 P24864 5/20 0.44
▸ CDK1 P06493 4/20 0.44
▸ CCNH P51946 4/20 0.44
▸ MNAT1 P51948 4/20 0.44
▸ CDK9 P50750 3/20 0.44
▸ CDK5 Q00535 3/20 0.44
▸ CDK4 P11802 2/20 0.44
▸ CDK6 Q00534 2/20 0.44
▸ CDK8 P49336 1/20 0.44
▸ CCNT1 O60563 4/20 0.43
▸ DYRK3 O43781 1/20 0.43
▸ CLK1 P49759 1/20 0.43
▸ CLK2 P49760 1/20 0.43
▸ CLK3 P49761 1/20 0.43
▸ DYRK1A Q13627 1/20 0.43

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
SCHEMBL24791683 1.00 CDK2 (0.45) CDK2CCNA2CHEK1CCNA1CDK7
SCHEMBL24791659 1.00 CDK2 (0.45) CDK2CCNA2CHEK1CCNA1CDK7
SCHEMBL24791508 0.95 CDK2 (0.49) CDK2CCNA2CHEK1CCNA1CDK7
SCHEMBL24791510 0.95 CDK2 (0.49) CDK2CCNA2CHEK1CCNA1CDK7
SCHEMBL24792971 0.95 CDK2 (0.47) CDK2CCNA2CHEK1CCNA1CDK7
SCHEMBL24792972 0.94 CDK7 (0.46) CDK2CCNA2CHEK1CCNA1CDK7
SCHEMBL24791654 0.91 CDK7 (0.44) CDK2CCNA2CHEK1CCNA1CDK7
SCHEMBL24792394 0.88 CSNK2A2 (0.39) CDK2CCNA2CHEK1CCNA1CDK7
SCHEMBL24791518 0.88 CSNK2A2 (0.54) CDK2CCNA2CHEK1CCNA1CDK7
SCHEMBL24791444 0.87 CDK2 (0.49) CDK2CCNA2CHEK1CCNA1CDK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022263604-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIMIDINE-7-AMINE COMPOUNDS AS CDK INHIBITORS AND THEIR THERAPEUTIC USE Carrick Therapeutics Limited (IE) 2022-12-22 — — WO disclosed
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