SCHEMBL15024908

SCHEMBL15024908

CCCCn1c2cc(C#Cc3ccc(-c4ccc(-c5cccs5)s4)s3)ccc2c2c3ccc(C#Cc4ccc(-c5ccc(-c6cccs6)s5)s4)cc3n(CCCC)c21

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.35
▸ RXFP1 Q9HBX9 1/20 0.35
▸ HPGD P15428 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ KDM4E B2RXH2 4/20 0.34
▸ TSHR P16473 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ POLB P06746 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ CASP1 P29466 1/20 0.34
▸ CASP7 P55210 1/20 0.34
▸ DPP4 P27487 4/20 0.33
▸ GAA P10253 2/20 0.33
▸ TDP1 Q9NUW8 1/20 0.31
▸ LMNA P02545 1/20 0.31

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
SCHEMBL20402219 0.80 KDM4E (0.34) ALDH1A1KDM4EGAA
SCHEMBL15024936 0.75 GRM5 (0.44) ALDH1A1MEN1KMT2ATSHRTDP1
SCHEMBL19074292 0.74 DPP4 (0.32) ALDH1A1KDM4ETSHRHSD17B10POLB
SCHEMBL15024749 0.73 ALDH1A1 (0.40) ALDH1A1RXFP1HPGDMEN1KMT2A
SCHEMBL15180626 0.72 DPP4 (0.35) ALDH1A1HPGDMEN1KMT2AKDM4E
SCHEMBL17521787 0.70 KDM4E (0.33) ALDH1A1KDM4EDPP4
SCHEMBL15024949 0.69 ALDH1A1 (0.40) ALDH1A1RXFP1HPGDMEN1KMT2A
SCHEMBL12964715 0.69 DPP4 (0.52) ALDH1A1HPGDMEN1KMT2AKDM4E
SCHEMBL498743 0.68 ADORA3 (0.46) ALDH1A1KDM4EDPP4GAALMNA
SCHEMBL12964717 0.68 LTA4H (0.50) ALDH1A1HPGDMEN1KMT2AKDM4E

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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