SCHEMBL26489297

SCHEMBL26489297

c1ccc(-c2ccc(-c3ccccc3N(c3ccc(-c4cccc5c4oc4c6ccccc6ccc54)cc3)c3ccc(-c4cccc5c4oc4c6ccccc6ccc54)cc3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A1 P04798 12/20 0.39
▸ CYP1B1 Q16678 12/20 0.39
▸ CYP1A2 P05177 11/20 0.39
▸ ABCG2 Q9UNQ0 3/20 0.39
▸ ABCC1 P33527 2/20 0.39
▸ PRKDC P78527 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ PDE5A O76074 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ ABCB1 P08183 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ CYP19A1 P11511 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ CYP2B6 P20813 1/20 0.39
▸ TACR2 P21452 1/20 0.39

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
SCHEMBL24887474 1.00 CYP1A1 (0.39) CYP1A1CYP1B1CYP1A2ABCG2ABCC1
SCHEMBL24887999 1.00 CYP1A1 (0.39) CYP1A1CYP1B1CYP1A2ABCG2ABCC1
SCHEMBL24888272 1.00 CYP1A1 (0.39) CYP1A1CYP1B1CYP1A2ABCG2ABCC1
SCHEMBL26489266 0.99 CYP1A1 (0.40) CYP1A1CYP1B1CYP1A2ABCG2ABCC1
SCHEMBL24888286 0.96 CYP1A1 (0.39) CYP1A1CYP1B1CYP1A2ABCG2ABCC1
SCHEMBL26489300 0.95 CYP1A1 (0.39) CYP1A1CYP1B1CYP1A2ABCG2ABCC1
SCHEMBL24887484 0.95 CYP1A1 (0.38) CYP1A1CYP1B1CYP1A2ABCG2ABCC1
SCHEMBL24887685 0.94 CYP1A1 (0.42) CYP1A1CYP1B1CYP1A2ABCG2ABCC1
SCHEMBL26489303 0.94 CYP1A1 (0.39) CYP1A1CYP1B1CYP1A2ABCG2ABCC1
SCHEMBL27302837 0.94 CYP1A1 (0.39) CYP1A1CYP1B1CYP1A2ABCG2ABCC1

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-20230329025-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-10-12 — — US disclosed
US-20230329025-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-10-12 — — US disclosed
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