SCHEMBL18499161

SCHEMBL18499161

c1cc2nc(-c3ccc4c(c3)NCCCCCC4)cc(Nc3ccc(N4CCOCC4)cn3)n2n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 4/20 0.38
▸ CDK6 Q00534 3/20 0.38
▸ CDK2 P24941 2/20 0.38
▸ CDK4 P11802 2/20 0.38
▸ CCNE1 P24864 1/20 0.38
▸ SYK P43405 5/20 0.37
▸ BTK Q06187 2/20 0.36
▸ PIM1 P11309 1/20 0.36
▸ PRKCI P41743 1/20 0.36
▸ ALOX5 P09917 1/20 0.35
▸ IKBKE Q14164 3/20 0.35
▸ TBK1 Q9UHD2 3/20 0.35
▸ CCNA2 P20248 1/20 0.35
▸ CCND1 P24385 1/20 0.35
▸ CCND3 P30281 1/20 0.35
▸ AXL P30530 1/20 0.35
▸ FLT3 P36888 1/20 0.35
▸ TYRO3 Q06418 1/20 0.35
▸ MERTK Q12866 1/20 0.35
▸ JAK2 O60674 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
SCHEMBL18499163 1.00 TYK2 (0.38) TYK2CDK6CDK2CDK4CCNE1
SCHEMBL2475810 0.86 SYK (0.44) TYK2CDK6CDK2CDK4CCNE1
SCHEMBL2473718 0.84 SYK (0.45) TYK2CDK2CCNE1SYKJAK2
SCHEMBL2474068 0.81 JAK2 (0.47) TYK2CDK2CCNE1SYKBTK
SCHEMBL2474769 0.80 MAP3K11 (0.49) TYK2CDK6CDK2CCNE1SYK
SCHEMBL13288359 0.79 SYK (0.59) SYKBTKFLT3JAK2
SCHEMBL2476464 0.79 SYK (0.47) TYK2CDK2CCNE1SYKBTK
SCHEMBL18498989 0.78 CCND3 (0.41) TYK2CDK6CDK2CDK4SYK
SCHEMBL18499162 0.78 SYK (0.39) CDK2CCNE1SYKDPP4
SCHEMBL2478695 0.76 SYK (0.42) CDK6CDK4SYKCCND1

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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