SCHEMBL18498988

SCHEMBL18498988

Cc1ccc(-c2cc(Nc3ccc(N(C)CCO)cn3)n3nccc3n2)cc1N

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 3/20 0.40
▸ CDK2 P24941 12/20 0.36
▸ CCNE1 P24864 11/20 0.36
▸ CCNT1 O60563 5/20 0.34
▸ CDK9 P50750 5/20 0.34
▸ MAP4K4 O95819 1/20 0.33
▸ CYP11B1 P15538 1/20 0.33
▸ CDK1 P06493 3/20 0.33
▸ CDK4 P11802 3/20 0.33
▸ CCNA2 P20248 3/20 0.33
▸ CCND1 P24385 3/20 0.33
▸ CDK7 P50613 3/20 0.33
▸ CCNH P51946 3/20 0.33
▸ CCNA1 P78396 3/20 0.33
▸ CDK3 Q00526 3/20 0.33
▸ CDK6 Q00534 2/20 0.33
▸ CDK5 Q00535 1/20 0.33
▸ CDK5R1 Q15078 1/20 0.33
▸ DPP4 P27487 1/20 0.31

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
SCHEMBL2478607 0.83 SYK (0.59) SYKCDK2CCNE1
SCHEMBL18499162 0.80 SYK (0.39) SYKCDK2CCNE1CCNT1CDK9
SCHEMBL18498989 0.76 CCND3 (0.41) SYKCDK2CDK9CDK4CCNA2
SCHEMBL14622374 0.63 ACP1 (0.45) CDK2CCNE1CCNT1CDK9
SCHEMBL5452864 0.60 CDK2 (0.67) CDK2CCNE1CDK1
SCHEMBL2474068 0.59 JAK2 (0.47) SYKCDK2CCNE1
SCHEMBL4518931 0.59 POLB (0.42) SYKMAP4K4
SCHEMBL31602238 0.58 KCNN3 (0.45) CDK2DPP4
SCHEMBL14427340 0.57 TSHR (0.49) SYKCDK2CCNE1CCNT1CDK9
SCHEMBL5550263 0.57 S100B (0.53) MAP4K4

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
US-9567348-B2 Substituted pyrazolo[1,5-a]pyrimidines as Syk inhibitors GILEAD CONNECTICUT, INC. (US) 2017-02-14 — — US disclosed
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