SCHEMBL19492669

SCHEMBL19492669

COc1c(C(=O)NC[C@H]2CCOc3ccccc32)cnc2c(Br)c(C)nn12

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 16/20 0.38
▸ MAPT P10636 2/20 0.36
▸ KDM6B O15054 2/20 0.35
▸ LMNA P02545 1/20 0.34

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
SCHEMBL20768157 0.86 MAPK1 (0.41) —
SCHEMBL20768155 0.86 MAPK1 (0.41) —
SCHEMBL20768140 0.77 BRD4 (0.41) —
SCHEMBL19492620 0.77 BRD4 (0.41) —
SCHEMBL19492619 0.75 KCNH2 (0.33) KDM4C
SCHEMBL20768124 0.75 MAPK1 (0.40) —
SCHEMBL19492795 0.75 MAPK1 (0.40) —
SCHEMBL19492794 0.74 KDM4C (0.32) KDM4CMAPTKDM6B
SCHEMBL19464216 0.73 BRD4 (0.40) —
SCHEMBL19464218 0.73 BRD4 (0.40) —

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
WO-2017178416-A1 PYRAZOLOPYRIMIDINE DERIVATIVES BAYER ANIMAL HEALTH GMBH (DE) 2017-10-19 — — WO disclosed
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