SCHEMBL6761344

SCHEMBL6761344

C=CCc1ccccc1NN

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 2/20 0.45
ADRA2B P18089 1/20 0.45
GABRA1 P14867 1/20 0.42
GABRB2 P47870 1/20 0.42
ALDH1A1 P00352 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
POLB P06746 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAPT P10636 2/20 0.37
GAA P10253 1/20 0.37
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA6 P23280 1/20 0.35
CA5A P35218 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA5B Q9Y2D0 1/20 0.35

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
Hydrochloric Acid SCHEMBL27904214 0.98 ADRA2C (0.44) ADRA2CADRA2BGABRA1GABRB2ALDH1A1
SCHEMBL176287 0.83 ADRA2C (0.47) ADRA2CADRA2BGABRA1GABRB2ALDH1A1
SCHEMBL7914371 0.81 KDM4E (0.44) ADRA2CADRA2BGABRA1GABRB2ALDH1A1
SCHEMBL8613162 0.79 ADRA2C (0.45) ADRA2CADRA2BGABRA1GABRB2ALDH1A1
SCHEMBL11815807 0.79 GABRA1 (0.47) ADRA2CADRA2BGABRA1GABRB2ALDH1A1
SCHEMBL9416673 0.79 ADRA2C (0.45) ADRA2CADRA2BGABRA1GABRB2ALDH1A1
SCHEMBL14236920 0.79 ADRA2C (0.45) ADRA2CADRA2BGABRA1GABRB2ALDH1A1
SCHEMBL9287668 0.78 ADRA2B (0.51) ADRA2CADRA2BGABRA1GABRB2ALDH1A1
SCHEMBL11034063 0.78 ADRA2B (0.44) ADRA2CADRA2BGABRA1GABRB2ALDH1A1
SCHEMBL6938134 0.77 TLR8 (0.45) ADRA2CADRA2BALDH1A1L3MBTL1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115772111-A Alkyl indole polyether carboxylate surfactant and preparation method and application thereof 中国石油化工股份有限公司 2023-03-10 CN claimed
WO-1998017666-A2 PROCESS FOR THE PREPARATION OF TETRAHYDRO-5-OXO-PYRROLIZINE DERIVATIVES MERCKLE GMBH (DE) 1998-04-30 WO claimed
EP-0348261-B1 Radiohalogenated compounds for site specific labeling CYTOGEN CORP (US) 1993-12-15 EP claimed
US-4966999-A Radiohalogenated compounds for site specific labeling CYTOGEN CORPORATION (US) 1990-10-30 US claimed
EP-0348261-A1 Radiohalogenated compounds for site specific labeling CYTOGEN CORPORATION (US) 1989-12-27 EP claimed
WO-1989011876-A1 RADIOHALOGENATED COMPOUNDS FOR SITE SPECIFIC LABELING CYTOGEN CORPORATION (US) 1989-12-14 WO claimed
CN-115772111-A Alkyl indole polyether carboxylate surfactant and preparation method and application thereof 中国石油化工股份有限公司 2023-03-10 CN disclosed
US-20040176241-A1 Benzoindenoindolyl metal catalysts for olefin polymerization EQUISTAR CHEMICALS, LP 2004-09-09 US disclosed
EP-0348261-B1 Radiohalogenated compounds for site specific labeling CYTOGEN CORP (US) 1993-12-15 EP disclosed
US-4966999-A Radiohalogenated compounds for site specific labeling CYTOGEN CORPORATION (US) 1990-10-30 US disclosed
EP-0348261-A1 Radiohalogenated compounds for site specific labeling CYTOGEN CORPORATION (US) 1989-12-27 EP disclosed
WO-1989011876-A1 RADIOHALOGENATED COMPOUNDS FOR SITE SPECIFIC LABELING CYTOGEN CORPORATION (US) 1989-12-14 WO disclosed
EP-0034285-B1 PROCESS FOR THE PREPARATION OF 1-ALKYL-1-PHENYL HYDRAZINES HOECHST AKTIENGESELLSCHAFT (DE) 1985-11-06 EP disclosed
US-4454212-A PHENYLHYDRAZONE OF CARBAZOLE ALDEHYDE RICOH COMPANY LIMITED (JP) 1984-06-12 US disclosed
US-4375559-A CATALYTIC HYDROGENATION OF NITRO-ALKYLBENZENES AIR PRODUCTS AND CHEMICALS, INC. (US) 1983-03-01 US disclosed
US-4375559-A CATALYTIC HYDROGENATION OF NITRO-ALKYLBENZENES AIR PRODUCTS AND CHEMICALS, INC. (US) 1983-03-01 US disclosed
US-4365014-A CARBAZOLE HYDRAZONE COMPOUNDS AS CHARGE TRANSPORT MATERIALS RICOH COMPANY, LIMITED (JP) 1982-12-21 US disclosed
EP-0034285-A2 Process for the preparation of 1-alkyl-1-phenyl hydrazines HOECHST AKTIENGESELLSCHAFT (DE) 1981-08-26 EP disclosed