SCHEMBL7742191

SCHEMBL7742191

Nc1ccc2cccc3c2c1C(=O)C=C3

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 3/20 0.39
ALDH1A1 P00352 7/20 0.37
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
HSD17B10 Q99714 4/20 0.37
MAPT P10636 4/20 0.37
USP2 O75604 3/20 0.37
KDM4E B2RXH2 3/20 0.37
ALOX15 P16050 3/20 0.37
POLB P06746 2/20 0.37
MPI P34949 1/20 0.37
HTT P42858 1/20 0.37
CACNA1B Q00975 1/20 0.37
APBA1 Q02410 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
JAK2 O60674 1/20 0.36
RPS6KA3 P51812 1/20 0.36
MELK Q14680 1/20 0.36
STK24 Q9Y6E0 1/20 0.36
THRB P10828 3/20 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
SCHEMBL8370836 0.82 ALDH1A1 (0.41) CES1ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL10978229 0.79 ALDH1A1 (0.34) ALDH1A1HSD17B10HPGDCYP1A2CYP3A4
SCHEMBL7741295 0.79 TXNRD1 (0.52) CES1ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL10979960 0.79 CES1 (0.39) CES1ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL7741267 0.79 ALDH1A1 (0.34) ALDH1A1HSD17B10HPGDCYP1A2CYP3A4
SCHEMBL11104716 0.78 CES1 (0.36) CES1ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL20493758 0.77 TXNRD1 (0.50) CES1ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL7741285 0.77 TXNRD1 (0.50) CES1ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL7741289 0.77 CES1 (0.38) CES1ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL27944321 0.77 ADORA2A (0.42) CES1ALDH1A1MEN1KMT2AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0093967-B1 PROCESS FOR THE PREPARATION OF ELECTRICALLY CONDUCTIVE SYSTEMS FROM SUBSTITUTED PHENALENES, PRODUCTS SO PREPARED AND THEIR APPLICATION BASF Aktiengesellschaft (DE) 1987-07-22 EP claimed
US-4518535-A Preparation of electrically conductive systems from substituted phenalenes, and the products obtained BASF AKTIENGESELLSCHAFT (DE) 1985-05-21 US claimed
EP-0093967-A2 Process for the preparation of electrically conductive systems from substituted phenalenes, products so prepared and their application BASF Aktiengesellschaft (DE) 1983-11-16 EP claimed
US-6428912-B1 ALUMINUM TRIS(9-OXIDOPHENALENONE) OR TRIS(6-OXIDOBENZANTHRONE) DERIVATIVE CHELATE COMPOUNDS; ELECTROLUMINESCENT AGERE SYSTEMS GUARDIAN CORP. 2002-08-06 US disclosed
EP-0093967-B1 PROCESS FOR THE PREPARATION OF ELECTRICALLY CONDUCTIVE SYSTEMS FROM SUBSTITUTED PHENALENES, PRODUCTS SO PREPARED AND THEIR APPLICATION BASF Aktiengesellschaft (DE) 1987-07-22 EP disclosed
EP-0054136-B1 PROCESS FOR THE MANUFACTURE OF ELECTRICALLY CONDUCTIVE POLYMERS AND THEIR USE IN ELECTRO-TECHNICS AND FOR THE ANTISTATIC EQUIPMENT OF PLASTICS BASF Aktiengesellschaft (DE) 1986-01-22 EP disclosed
US-4518535-A Preparation of electrically conductive systems from substituted phenalenes, and the products obtained BASF AKTIENGESELLSCHAFT (DE) 1985-05-21 US disclosed
EP-0069292-B1 POLYMERS WITH AT LEAST TWO STABLE AND REVERSIBLY INTERCHANGEABLE OXIDATION STEPS, PROCESS FOR THEIR PREPARATION AND THEIR USE BASF Aktiengesellschaft (DE) 1985-05-15 EP disclosed
US-4464511-A ELECTROCONDUCTIVITY, ELECTROCHROMIC, ANTISTATIC AGENTS BASF AKTIENGESELLSCHAFT (DE) 1984-08-07 US disclosed
US-4440693-A Preparation of electrically conductive products BASF AKTIENGESELLSCHAFT (DE) 1984-04-03 US disclosed
EP-0093967-A2 Process for the preparation of electrically conductive systems from substituted phenalenes, products so prepared and their application BASF Aktiengesellschaft (DE) 1983-11-16 EP disclosed
EP-0069292-A1 Polymers with at least two stable and reversibly interchangeable oxidation steps, process for their preparation and their use BASF Aktiengesellschaft (DE) 1983-01-12 EP disclosed
EP-0054136-A1 Process for the manufacture of electrically conductive polymers and their use in electro-technics and for the antistatic equipment of plastics BASF Aktiengesellschaft (DE) 1982-06-23 EP disclosed