SCHEMBL9912960

SCHEMBL9912960

Cc1ccc(N(c2ccc(C)cc2)c2cc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc(-n3c4ccc(N(c5ccc(C)cc5)c5ccc(C)cc5)cc4c4cc(N(c5ccc(C)cc5)c5ccc(C)cc5)ccc43)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
ICMT O60725 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
SCHEMBL9912945 0.94 APP (0.37) POLBKDM4EGAAMAPTALDH1A1
SCHEMBL26281095 0.93 POLB (0.35) POLBKDM4EGAAMAPTALDH1A1
SCHEMBL15595166 0.90 KDM4E (0.41) KDM4EGAAMAPTALDH1A1
SCHEMBL15595253 0.90 KDM4E (0.41) KDM4EGAAMAPTALDH1A1
SCHEMBL9912873 0.90 POLB (0.43) POLBKDM4EGAAMAPTALDH1A1
SCHEMBL17807588 0.90 POLB (0.43) POLBKDM4EGAAMAPTALDH1A1
SCHEMBL15595174 0.90 APP (0.36) POLBKDM4EGAAMAPTALDH1A1
SCHEMBL9912940 0.87 POLB (0.34) POLBKDM4EGAAMAPTALDH1A1
SCHEMBL15595074 0.87 KDM4E (0.41) KDM4EGAAMAPTALDH1A1
SCHEMBL15595215 0.87 KDM4E (0.41) KDM4EGAAMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8198801-B2 Materials for injecting or transporting holes and organic electroluminescence devices using the same LG CHEM, LTD. (KR) 2012-06-12 US disclosed
US-8198801-B2 Materials for injecting or transporting holes and organic electroluminescence devices using the same LG CHEM, LTD. (KR) 2012-06-12 US disclosed