SCHEMBL451030

SCHEMBL451030

c1ccc([N+](c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
LMNA P02545 2/20 0.47
TDP1 Q9NUW8 5/20 0.41
HSD17B10 Q99714 3/20 0.41
CYP3A4 P08684 2/20 0.41
HPGD P15428 2/20 0.41
TSHR P16473 4/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
ALOX12 P18054 2/20 0.35
CA12 O43570 1/20 0.35
GLA P06280 1/20 0.35
CA3 P07451 1/20 0.35
CA4 P22748 1/20 0.35
CA14 Q9ULX7 1/20 0.35
ACHE P22303 1/20 0.35
CA7 P43166 1/20 0.35
MAOB P27338 1/20 0.35
CYP2A6 P11509 1/20 0.33

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
SCHEMBL7948763 0.82 ACHE (0.53) ALDH1A1LMNATDP1HSD17B10HPGD
SCHEMBL5363973 0.79 ALDH1A1 (0.56) ALDH1A1TDP1HSD17B10CYP3A4CA1
SCHEMBL3108934 0.69
SCHEMBL49458 0.69
SCHEMBL11755153 0.69 ALDH1A1 (0.43) ALDH1A1LMNATDP1HSD17B10CYP3A4
SCHEMBL786960 0.69 ALDH1A1 (0.50) ALDH1A1LMNATDP1HSD17B10CYP3A4
SCHEMBL10516996 0.69 ALDH1A1 (0.43) ALDH1A1LMNATDP1HSD17B10CYP3A4
SCHEMBL9644038 0.69 ALDH1A1 (0.43) ALDH1A1LMNATDP1HSD17B10CYP3A4
SCHEMBL1925151 0.69
SCHEMBL1796549 0.69 ALDH1A1 (0.43) ALDH1A1LMNATDP1HSD17B10CYP3A4

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 308 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11038132-B2 Optoelectronic devices with organometal perovskites with mixed anions OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2021-06-15 US claimed
CN-112592465-A Osmium-containing heteropentadiyne conjugated polymer with main chain and preparation method and application thereof 厦门大学 2021-04-02 CN claimed
CN-108774154-B Trianilinometalononitrile, synthesis method and CN recognition-Method (2) 阜阳师范大学 2020-11-10 CN claimed
CN-111499650-A Charge transport material and preparation method and application thereof 上海和辉光电股份有限公司 2020-08-07 CN claimed
CN-108148055-A A kind of D- π-A types organic fluorescence materials and preparation method based on naphthalene 陕西师范大学 2018-06-12 CN claimed
EP-3124552-B1 TRANS-DISUBSTITUTED BENZODIAZAPORPHYRINS AS SENSITIZERS FOR SOLAR CELLS UNIV NANTES (FR) 2018-04-11 EP claimed
EP-2580252-B1 METHODS FOR PRODUCING TELECHELIC POLYOLEFINS FROM TERPENE INITIATORS CHEVRON ORONITE CO (US) 2016-11-09 EP claimed
EP-2376595-B1 PHOTOACTIVE COMPOSITION AND ELECTRONIC DEVICE MADE WITH THE COMPOSITION DU PONT (US) 2015-01-21 EP claimed
CN-102484213-A Organic light-emitting diode lamp DU PONT 2012-05-30 CN claimed
CN-102484214-A Organic light-emitting diode luminaires DU PONT 2012-05-30 CN claimed
CN-102484219-A Organic light-emitting diode lamp DU PONT 2012-05-30 CN claimed
CN-102239230-A Photoactive composition and electronic device made with the composition DU PONT 2011-11-09 CN claimed
CN-101546812-B Organic electroluminescent element and display device including the same FUJI XEROX CO LTD 2010-10-13 CN claimed
CN-101546812-A Organic electroluminescent element and display device including the same FUJI XEROX CO LTD 2009-09-30 CN claimed
CN-1356596-A Charge transfer compound, organic light sensor containing said compoud for electronic photography and imaging device and method for electronic photography SAMSHUNG ELECTRONICS LTD (KR) 2002-07-03 CN claimed
EP-0812259-A4 ELECTROLUMINESCENT DEVICE POLAROID CORP (US) 1998-04-15 EP claimed
EP-0812259-A1 ELECTROLUMINESCENT DEVICE POLAROID CORPORATION (US) 1997-12-17 EP claimed
WO-1996021559-A1 ELECTROLUMINESCENT DEVICE POLAROID CORPORATION (US) 1996-07-18 WO claimed
JP-5053349-A None JP disclosed
EP-0284938-A2 Photopolymerisable composition and registration material prepared therewith HOECHST AKTIENGESELLSCHAFT (DE) 1988-10-05 EP disclosed