SCHEMBL23679176

SCHEMBL23679176

FC(F)(F)c1cc(-c2cc(-n3c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4c4cc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)ccc43)ccc2-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc(C(F)(F)F)c1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
NR3C1 P04150 1/20 0.35
PGR P06401 1/20 0.35
ABCG2 Q9UNQ0 5/20 0.33
TDP1 Q9NUW8 1/20 0.33
ICMT O60725 1/20 0.33
MET P08581 2/20 0.33
DPP4 P27487 1/20 0.33
TEAD1 P28347 1/20 0.32
TEAD4 Q15561 1/20 0.32
TEAD2 Q15562 1/20 0.32
TEAD3 Q99594 1/20 0.32
METAP2 P50579 1/20 0.32
ADORA2A P29274 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
PPARG P37231 1/20 0.32
S1PR1 P21453 1/20 0.32

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
SCHEMBL20777638 0.97 ABCG2 (0.34) LMNAPOLBNR3C1PGRABCG2
SCHEMBL23679096 0.97 NR3C1 (0.36) LMNAPOLBNR3C1PGRABCG2
SCHEMBL23679174 0.94 L3MBTL1 (0.37) LMNAPOLBNR3C1PGRABCG2
SCHEMBL23679097 0.94 NR3C1 (0.35) LMNAPOLBNR3C1PGRABCG2
SCHEMBL23679115 0.94 NR3C1 (0.35) LMNAPOLBNR3C1PGRABCG2
SCHEMBL23679045 0.93 NR3C1 (0.37) LMNAPOLBNR3C1PGRABCG2
SCHEMBL20777483 0.93 NR3C1 (0.37) LMNAPOLBNR3C1PGRABCG2
SCHEMBL23679208 0.93 ABCG2 (0.37) LMNAPOLBNR3C1PGRABCG2
SCHEMBL23679039 0.92 ABCG2 (0.35) LMNAPOLBABCG2TDP1MET
SCHEMBL23543340 0.92 NR3C1 (0.41) LMNANR3C1PGRABCG2TDP1

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
EP-3673031-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2021-07-28 EP disclosed