SCHEMBL17786644

SCHEMBL17786644

c1cnc2ccc3ccc(-c4ncc[nH]4)nc3c2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.54
CYP3A4 P08684 2/20 0.44
KDM4E B2RXH2 4/20 0.43
MAPT P10636 3/20 0.43
MTOR P42345 2/20 0.38
ADK P55263 1/20 0.38
NISCH Q9Y2I1 1/20 0.38
HSP90AA1 P07900 2/20 0.36
HTT P42858 2/20 0.36
HIF1A Q16665 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
HSP90AB1 P08238 1/20 0.36
BLM P54132 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
TP53 P04637 2/20 0.35
ALOX15 P16050 2/20 0.35
TSHR P16473 2/20 0.35
GMNN O75496 1/20 0.35
MMP2 P08253 1/20 0.35

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
SCHEMBL7352414 0.86 LMNA (0.44) LMNACYP3A4KDM4EMAPTMTOR
SCHEMBL12075533 0.81 CCR1 (0.53) LMNACYP3A4KDM4EMAPTMTOR
2-Phenylimidazole SCHEMBL27944740 0.79 LMNA (0.62) LMNACYP3A4KDM4EMAPTMTOR
SCHEMBL14900763 0.77 LMNA (0.59) LMNACYP3A4KDM4EMAPTMTOR
SCHEMBL12470533 0.77 LMNA (0.64) LMNACYP3A4KDM4EMAPTMTOR
SCHEMBL28462536 0.77 LMNA (0.54) LMNACYP3A4KDM4EMAPTMTOR
SCHEMBL27681790 0.76 LMNA (0.73) LMNACYP3A4KDM4EMAPTMTOR
SCHEMBL669488 0.75 LMNA (0.61) LMNACYP3A4KDM4EMAPTMTOR
SCHEMBL4246178 0.75 LMNA (0.61) LMNACYP3A4KDM4EMAPTMTOR
SCHEMBL28724677 0.75 LMNA (0.70) LMNACYP3A4KDM4EMAPTMTOR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102491987-B 1,10-phenanthroline hydrate functionalized N-heterocyclic carbene and tetranuclear copper compound and preparation method for same UNIV WUHAN TEXTILE 2014-06-11 CN claimed
CN-102491987-A 1,10-phenanthroline hydrate functionalized N-heterocyclic carbene and tetranuclear copper compound and preparation method for same UNIV WUHAN TEXTILE 2012-06-13 CN claimed
WO-2016086022-A2 HETEROAROMATIC IMIDAZOLYL COMPOUNDS AND METHODS FOR TREATING CANCER CHANNEL THERAPEUTICS, INC. (US) 2016-06-02 WO disclosed
CN-102491987-B 1,10-phenanthroline hydrate functionalized N-heterocyclic carbene and tetranuclear copper compound and preparation method for same UNIV WUHAN TEXTILE 2014-06-11 CN disclosed
CN-102491987-A 1,10-phenanthroline hydrate functionalized N-heterocyclic carbene and tetranuclear copper compound and preparation method for same UNIV WUHAN TEXTILE 2012-06-13 CN disclosed