SCHEMBL10148967

SCHEMBL10148967

Cc1ccc2c(c1)c1cc(CC(C)(C)C)ccc1n2-c1ccc(-c2nnc3c4ccccc4ccn23)cc1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.37
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.34
KMT2A Q03164 1/20 0.34
PGR P06401 1/20 0.31
RORA P35398 1/20 0.31
RORC P51449 1/20 0.31
RORB Q92753 1/20 0.31
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL10128221 0.89 ALDH1A1 (0.41) MAPTALDH1A1KDM4EKMT2ARXFP1
SCHEMBL10128220 0.87 ALDH1A1 (0.40) MAPTALDH1A1KDM4EKMT2ARXFP1
SCHEMBL10128228 0.85 HSD11B1 (0.34) MAPTALDH1A1KDM4EKMT2APGR
SCHEMBL10128226 0.85 MAPT (0.37) MAPTALDH1A1KDM4EKMT2APGR
SCHEMBL10128230 0.84 HSD11B1 (0.42) MAPTPGRRORARORCRORB
SCHEMBL10148971 0.83 MAPT (0.36) MAPTALDH1A1KDM4EKMT2APGR
SCHEMBL10128268 0.83 ALDH1A1 (0.42) MAPTALDH1A1KDM4EKMT2ARXFP1
SCHEMBL10128234 0.83 DRD1 (0.33) MAPTALDH1A1KDM4EKMT2ARXFP1
SCHEMBL10128239 0.82 MAPT (0.39) MAPTALDH1A1KDM4EKMT2APGR
SCHEMBL10148546 0.81 POLB (0.41) MAPTALDH1A1KDM4EPGRRORA

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-2012017842-A1 TRIAZOLE DERIVATIVE, HETEROCYCLIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-02-09 WO disclosed