SCHEMBL21017207

SCHEMBL21017207

CCNc1nc(-c2cccnc2)nc2c1ncn2C(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 15/20 0.52
▸ CDK9 P50750 5/20 0.52
▸ CDK5 Q00535 3/20 0.52
▸ CCNA2 P20248 2/20 0.52
▸ CCNA1 P78396 2/20 0.52
▸ CDK5R1 Q15078 2/20 0.52
▸ DYRK1A Q13627 1/20 0.52
▸ CDK1 P06493 13/20 0.52
▸ CDK4 P11802 12/20 0.52
▸ CDK7 P50613 12/20 0.52
▸ CCNE1 P24864 12/20 0.52
▸ MAPK1 P28482 11/20 0.52
▸ CCNH P51946 11/20 0.52
▸ CCNB1 P14635 11/20 0.52
▸ CCND1 P24385 10/20 0.52
▸ CCNT1 O60563 4/20 0.52
▸ MNAT1 P51948 1/20 0.52
▸ CDK6 Q00534 1/20 0.52
▸ CCNE2 O96020 1/20 0.51
▸ CCNK O75909 4/20 0.50

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
SCHEMBL2315371 0.90 CDK2 (0.54) CDK2CDK9CDK5CCNA2CCNA1
SCHEMBL25309378 0.86 CDK2 (0.56) CDK2CDK9CDK5CCNA2CCNA1
SCHEMBL30518560 0.86 CDK2 (0.56) CDK2CDK9CDK5CCNA2CCNA1
SCHEMBL2318356 0.86 AHR (0.51) CDK2CDK9CDK5CCNA2CCNA1
SCHEMBL30315420 0.85 CCNK (0.55) CDK2CDK9CDK5CCNA2CCNA1
SCHEMBL2311460 0.85 CCNK (0.55) CDK2CDK9CDK5CCNA2CCNA1
SCHEMBL30518535 0.84 CCNK (0.64) CDK2CDK9CDK5CCNA2CCNA1
SCHEMBL25308297 0.84 CCNK (0.64) CDK2CDK9CDK5CCNA2CCNA1
SCHEMBL2310970 0.83 CDK5 (0.53) CDK2CDK9CDK5CCNA2CCNA1
SCHEMBL20895840 0.83 AHR (0.49) CDK2CDK9CDK5CCNA2CCNA1

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
EP-2788476-B1 COMPOSITIONS AND METHODS FOR ENHANCED GENERATION OF HEMATOPOIETIC STEM/PROGENITOR CELLS HUTCHINSON FRED CANCER RES (US) 2019-05-22 — — EP disclosed
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