SCHEMBL17527320

SCHEMBL17527320

COc1cc(N2CC[P](C)(O)CC2)ccc1Nc1nc(Nc2ccn(Cc3ccc(F)cc3)c2)ncc1Cl

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 20/20 0.53
▸ INSR P06213 1/20 0.53

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
SCHEMBL11900797 0.93 ALK (0.53) ALKINSR
SCHEMBL11900803 0.88 ALK (0.55) ALKINSR
SCHEMBL19288500 0.86 ALK (0.54) ALKINSR
SCHEMBL1493538 0.77 ALK (0.60) ALKINSR
SCHEMBL17527282 0.76 ALK (0.60) ALKINSR
SCHEMBL24255220 0.73 JAK3 (0.74) ALKINSR
SCHEMBL24255249 0.72 JAK3 (0.64) ALKINSR
SCHEMBL1493649 0.71 ALK (0.61) ALKINSR
SCHEMBL16752958 0.70 ALK (1.00) ALKINSR
SCHEMBL17527454 0.70 ALK (0.59) ALKINSR

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-9273077-B2 Phosphorus derivatives as kinase inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2016-03-01 — — US claimed
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