SCHEMBL15025056

SCHEMBL15025056

CCCCCCc1csc(-c2ccc(-c3ccc(-c4ccc5c6c7ccc(-c8ccc(-c9ccc(-c%10cc(CCCCCC)cs%10)s9)s8)cc7n(C)c6n(C)c5c4)s3)s2)c1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 4/20 0.35
▸ RORA P35398 1/20 0.31
▸ RORC P51449 1/20 0.31
▸ RORB Q92753 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ OXER1 Q8TDS5 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
SCHEMBL14881251 0.79 PTGS2 (0.42) KDM4E
SCHEMBL1492468 0.79 PTGS2 (0.42) KDM4E
SCHEMBL10046697 0.79 PTGS2 (0.42) KDM4E
SCHEMBL19074286 0.77 — —
SCHEMBL15024749 0.74 ALDH1A1 (0.40) KDM4E
SCHEMBL15024746 0.74 RORA (0.46) HSD11B1RORARORCRORBKDM4E
SCHEMBL15724612 0.73 PTGS2 (0.37) KDM4E
SCHEMBL17528653 0.72 HSD17B10 (0.44) KDM4ERAB9A
SCHEMBL3555634 0.72 PTGS2 (0.48) KDM4E
SCHEMBL2012315 0.72 PTGS2 (0.48) KDM4E

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2617724-B1 ORGANIC ELECTROLUMINESCENT DEVICE NIPPON STEEL & SUMIKIN CHEM CO (JP) 2017-07-05 — — EP disclosed
US-8766248-B2 Nitrogen-containing aromatic compound, organic semiconductor material, and organic electronic device NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) 2014-07-01 — — US disclosed
US-8766248-B2 Nitrogen-containing aromatic compound, organic semiconductor material, and organic electronic device NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) 2014-07-01 — — US disclosed
EP-2617724-A1 NITROGENATED AROMATIC COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL, AND ORGANIC ELECTRONIC DEVICE Nippon Steel & Sumikin Chemical Co., Ltd. (JP) 2013-07-24 — — EP disclosed
US-20130150576-A1 NITROGEN-CONTAINING AROMATIC COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL, AND ORGANIC ELECTRONIC DEVICE NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2013-06-13 — — US disclosed
US-20130150576-A1 NITROGEN-CONTAINING AROMATIC COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL, AND ORGANIC ELECTRONIC DEVICE NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2013-06-13 — — US disclosed
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