SCHEMBL20344867

SCHEMBL20344867

Cc1cn2cc(Br)nc(Nc3ccc(N4CCO[C@@H](CO)C4)cc3)c2n1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 6/20 0.53
▸ CD63 P08962 2/20 0.53
▸ TBK1 Q9UHD2 2/20 0.38
▸ TNK2 Q07912 3/20 0.38
▸ IGF1R P08069 2/20 0.37
▸ CCR4 P51679 1/20 0.36
▸ TRPV1 Q8NER1 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ CHEK1 O14757 1/20 0.36
▸ AURKA O14965 2/20 0.35
▸ CDK4 P11802 1/20 0.35
▸ CCND3 P30281 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
SCHEMBL15552545 0.85 SYK (0.71) SYKCD63AURKAJAK2
SCHEMBL15552542 0.85 SYK (0.71) SYKCD63AURKAJAK2
SCHEMBL16848689 0.85 SYK (0.71) SYKCD63AURKAJAK2
SCHEMBL15552238 0.78 SYK (0.62) SYKCD63AURKAJAK2
SCHEMBL15552562 0.76 SYK (0.66) SYKCD63AURKAJAK2
SCHEMBL15552563 0.76 SYK (0.66) SYKCD63AURKAJAK2
SCHEMBL15552276 0.73 SYK (0.53) SYKCD63AURKAJAK2
SCHEMBL15552279 0.73 SYK (0.53) SYKCD63AURKAJAK2
SCHEMBL16820600 0.71 SYK (0.78) SYKCD63AURKAJAK2
SCHEMBL16820596 0.71 SYK (0.78) SYKCD63AURKAJAK2

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-3342773-A1 SYK INHIBITORS Gilead Sciences, Inc. (US) 2018-07-04 — — EP disclosed
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