SCHEMBL18498989

SCHEMBL18498989

Cc1ccc(-c2cc(Nc3ccc(N4CCOCC4)cn3)n3nccc3n2)cc1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCND3 P30281 3/20 0.41
▸ CDK6 Q00534 3/20 0.41
▸ CCNK O75909 1/20 0.41
▸ CDK9 P50750 1/20 0.41
▸ JAK2 O60674 3/20 0.40
▸ SYK P43405 5/20 0.40
▸ CDK4 P11802 3/20 0.40
▸ CCND1 P24385 3/20 0.40
▸ CCNA2 P20248 2/20 0.40
▸ CDK2 P24941 2/20 0.40
▸ CD63 P08962 1/20 0.40
▸ TYK2 P29597 2/20 0.39
▸ LYN P07948 1/20 0.38
▸ SRC P12931 1/20 0.38
▸ AHR P35869 1/20 0.38
▸ BTK Q06187 1/20 0.38
▸ IKBKE Q14164 2/20 0.37
▸ TBK1 Q9UHD2 2/20 0.37
▸ DPP4 P27487 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37

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
SCHEMBL2474068 0.83 JAK2 (0.47) JAK2SYKCDK2TYK2BTK
SCHEMBL2474769 0.82 MAP3K11 (0.49) CDK6SYKCDK2TYK2BTK
SCHEMBL2478695 0.82 SYK (0.42) CDK6SYKCDK4CCND1LYN
SCHEMBL13288359 0.82 SYK (0.59) JAK2SYKBTK
SCHEMBL2475810 0.80 SYK (0.44) CCND3CDK6JAK2SYKCDK4
SCHEMBL2473718 0.80 SYK (0.45) JAK2SYKCDK2TYK2LYN
SCHEMBL2476464 0.78 SYK (0.47) JAK2SYKCDK2TYK2BTK
SCHEMBL18499163 0.78 TYK2 (0.38) CCND3CDK6JAK2SYKCDK4
SCHEMBL18499161 0.78 TYK2 (0.38) CCND3CDK6JAK2SYKCDK4
SCHEMBL18498988 0.76 SYK (0.40) CDK6CDK9SYKCDK4CCND1

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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