SCHEMBL23937404

SCHEMBL23937404

CC1(C)c2ccc(-c3cccc(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccc(-c7ccccc7)cc6)n5)cc4)c3)cc2-c2ccc(C#N)cc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 3/20 0.43
▸ PDK2 Q15119 3/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ CYP1A2 P05177 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ CYP3A4 P08684 2/20 0.40
▸ CYP2C19 P33261 2/20 0.40
▸ CLK4 Q9HAZ1 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ TSHR P16473 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ ABCG2 Q9UNQ0 9/20 0.39
▸ ABCB1 P08183 3/20 0.39
▸ MAPK1 P28482 1/20 0.37
▸ AR P10275 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ TP53 P04637 1/20 0.37

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
SCHEMBL23937412 0.99 PGR (0.42) PGRPDK2MEN1ALDH1A1CYP1A2
SCHEMBL23937529 0.99 PGR (0.42) PGRPDK2MEN1ALDH1A1CYP1A2
SCHEMBL23937399 0.99 PGR (0.42) PGRPDK2MEN1ALDH1A1CYP1A2
SCHEMBL23937413 0.99 PGR (0.42) PGRPDK2MEN1ALDH1A1CYP1A2
SCHEMBL23937395 0.98 CYP1A2 (0.42) PGRPDK2MEN1ALDH1A1CYP1A2
SCHEMBL23937398 0.97 PGR (0.41) PGRPDK2MEN1ALDH1A1CYP1A2
SCHEMBL23937646 0.95 PGR (0.46) PGRPDK2MEN1ALDH1A1CYP1A2
SCHEMBL23937695 0.94 PGR (0.43) PGRPDK2MEN1ALDH1A1CYP1A2
SCHEMBL23937523 0.94 PGR (0.45) PGRPDK2MEN1ALDH1A1CYP1A2
SCHEMBL23937525 0.94 PGR (0.45) PGRPDK2MEN1ALDH1A1CYP1A2

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-3896061-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME Solus Advanced Materials Co., Ltd. (KR) 2021-10-20 — — EP disclosed
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