SCHEMBL20194174

SCHEMBL20194174

CC(C)N/N=N\C(=N)c1cc(N)c2[nH]ccc2c1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 1/20 0.32

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
SCHEMBL20194130 0.69 F2 (0.45) F2
SCHEMBL22658191 0.68 PRKCI (0.41) —
SCHEMBL29433377 0.68 PRKCI (0.41) —
SCHEMBL28362761 0.67 KDM4E (0.49) —
SCHEMBL20987263 0.66 IKBKB (0.46) F2
SCHEMBL19286122 0.64 ALDH1A1 (0.40) —
SCHEMBL20194176 0.61 ALOX5 (0.36) —
SCHEMBL15934119 0.61 TDP1 (0.38) —
SCHEMBL16815127 0.61 IKBKB (0.35) —
SCHEMBL15388774 0.59 AHR (0.47) —

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-3054955-B1 PYRROLOTRIAZINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-05-30 — — EP disclosed
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