SCHEMBL12628232

SCHEMBL12628232

CCCCCCc1ccc(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.56
MEN1 O00255 5/20 0.52
KMT2A Q03164 5/20 0.52
ALDH1A1 P00352 4/20 0.52
MAPT P10636 4/20 0.52
HPGD P15428 3/20 0.52
KDM4E B2RXH2 2/20 0.52
RAB9A P51151 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
USP2 O75604 1/20 0.52
GAA P10253 1/20 0.52
HSD17B10 Q99714 1/20 0.52
DHODH Q02127 1/20 0.52
RARB P10826 5/20 0.51
RARA P10276 1/20 0.51
MTOR P42345 1/20 0.51
CTRC Q99895 1/20 0.51
NTSR1 P30989 1/20 0.50
ADORA3 P0DMS8 1/20 0.48
ADORA1 P30542 1/20 0.48

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
SCHEMBL12628223 0.91 HSD11B1 (0.62) HSD11B1MEN1KMT2AALDH1A1MAPT
SCHEMBL11976459 0.89 RAB9A (0.56) HSD11B1MEN1KMT2AALDH1A1MAPT
SCHEMBL16152355 0.89 HSD11B1 (0.60) HSD11B1MEN1KMT2AALDH1A1MAPT
SCHEMBL11976560 0.88 RAB9A (0.54) HSD11B1MEN1KMT2AALDH1A1MAPT
SCHEMBL11976561 0.88 RAB9A (0.54) HSD11B1MEN1KMT2AALDH1A1MAPT
SCHEMBL1659788 0.87 RAB9A (0.55) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL11976571 0.86 RAB9A (0.48) HSD11B1MEN1KMT2AALDH1A1MAPT
SCHEMBL16152370 0.86 HSD11B1 (0.43) HSD11B1MEN1KMT2AALDH1A1MAPT
SCHEMBL11976416 0.85 RAB9A (0.58) HSD11B1MEN1KMT2AALDH1A1MAPT
SCHEMBL12014975 0.85 HSD11B1 (0.43) HSD11B1MEN1KMT2AALDH1A1MAPT

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-9048442-B2 Composition containing a metal complex and organic compound, and light-emitting element using said compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-06-02 US disclosed
US-20110114890-A1 COMPOSITION CONTAINING A METAL COMPLEX AND ORGANIC COMPOUND, AND LIGHT-EMITTING ELEMENT USING SAID COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-05-19 US disclosed