SCHEMBL29625632

SCHEMBL29625632

CC(C)(C)c1ccc(N(c2cccc(-n3c4ccc(C(C)(C)C)cc4c4c5ccccc5ccc43)c2Br)c2cccc3ccccc23)cc1

nearest known ligand 0.31

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.31
▸ PGR P06401 1/20 0.31
▸ RORA P35398 1/20 0.31
▸ RORC P51449 1/20 0.31
▸ RORB Q92753 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ NR1I2 O75469 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ ADRA2A P08913 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30
▸ ACHE P22303 1/20 0.30
▸ SLC6A2 P23975 1/20 0.30
▸ HTR2A P28223 1/20 0.30
▸ SLC6A4 P31645 1/20 0.30
▸ KCNH2 Q12809 1/20 0.30
▸ SIGMAR1 Q99720 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
SCHEMBL29625557 0.90 PGR (0.32) CYP19A1PGRRORARORCRORB
SCHEMBL29625562 0.90 SIGMAR1 (0.34) CYP19A1PGRRORARORCRORB
SCHEMBL29625610 0.85 PGR (0.35) CYP19A1PGRRORARORCRORB
SCHEMBL29625595 0.83 PGR (0.30) PGRRORARORCRORB
SCHEMBL29625607 0.82 SIGMAR1 (0.33) SIGMAR1
SCHEMBL29625570 0.82 SIGMAR1 (0.32) SIGMAR1
SCHEMBL29625573 0.81 KIF11 (0.35) CYP19A1PGRRORARORCRORB
SCHEMBL29625566 0.81 KIF11 (0.35) CYP19A1PGRRORARORCRORB
SCHEMBL29625588 0.81 — —
SCHEMBL29625575 0.81 TDP1 (0.33) CYP19A1PGRRORARORCRORB

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
WO-2022131780-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME 솔루스첨단소재 주식회사 2022-06-23 — — WO disclosed
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