SCHEMBL21899404

SCHEMBL21899404

Cc1cnc2c(N)nc(-c3cncc(F)c3)nc2c1

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 19/20 0.40
PIM1 P11309 1/20 0.36

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
SCHEMBL21754322 0.78 TLR7 (0.40) TLR7
SCHEMBL20780662 0.71 CCR1 (0.45)
SCHEMBL30493685 0.70 CYP1A2 (0.54)
SCHEMBL23348864 0.70 HCAR2 (0.45) PIM1
SCHEMBL30579323 0.69 CDK2 (0.53) TLR7
SCHEMBL26638142 0.69 NQO2 (0.35) TLR7
SCHEMBL30493780 0.69 NQO2 (0.35) TLR7
SCHEMBL20839320 0.68 PIK3CA (0.39) TLR7PIM1
SCHEMBL29856247 0.68 PIK3CA (0.39) TLR7PIM1
SCHEMBL18194358 0.66 KDM4E (0.39) PIM1

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-2020081636-A1 INDOLE AHR INHIBITORS AND USES THEREOF Ikena Oncology, Inc. (US) 2020-04-23 WO disclosed