SCHEMBL6561234

SCHEMBL6561234

CC[N]Cc1ccc(Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 4/20 0.42
IDO1 P14902 3/20 0.42
MIF P14174 1/20 0.41
SLC6A2 P23975 2/20 0.40
SLC6A3 Q01959 2/20 0.40
SLC6A4 P31645 2/20 0.40
HTR2A P28223 1/20 0.40
HRH1 P35367 1/20 0.40
HTR2B P41595 1/20 0.40
CHRNA4 P43681 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 1/20 0.38
CYP2A6 P11509 1/20 0.38
AGXT P21549 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
AOC3 Q16853 1/20 0.38
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
HTR3A P46098 1/20 0.36
HTR3D Q70Z44 1/20 0.36

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
SCHEMBL943888 0.85 IDO1 (0.50) TAAR1IDO1MIFSLC6A2SLC6A3
SCHEMBL9232607 0.82 TAAR1 (0.40) TAAR1IDO1MIFSLC6A2SLC6A3
SCHEMBL5101986 0.78 IDO1 (0.44) TAAR1IDO1SMN1; SMN2CYP2A6AGXT
SCHEMBL2090624 0.77 IDO1 (0.48) TAAR1IDO1MIFSLC6A2SLC6A3
SCHEMBL8851885 0.76 TAAR1 (0.40) TAAR1IDO1HTR2ALMNACYP2A6
SCHEMBL8852123 0.76 MIF (0.54) TAAR1IDO1MIFLMNAAGXT
SCHEMBL3932463 0.76 IDO1 (0.48) TAAR1IDO1SLC6A2SLC6A3SLC6A4
SCHEMBL2145 0.75 ALDH1A1 (0.50) IDO1MIFLMNAGRIN2B
SCHEMBL28055976 0.74 IDO1 (0.50) TAAR1IDO1MIFSLC6A2SLC6A3
SCHEMBL8851617 0.73 MIF (0.60) TAAR1IDO1MIFSLC6A4SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1091946-B1 NEW 2-AMINOTHIAZOL-FUSED 2-AMINOINDANS AND 2-AMINOTETRALINS AND THEIR USE WIKSTROEM HAKAN VILHELM (NL) 2004-03-17 EP disclosed
US-6291494-B1 2-aminothiazol-fused 2-aminoindans and 2-aminotetralins and their use ASTRAZENECA AB (SE) 2001-09-18 US disclosed
EP-1091946-A1 NEW 2-AMINOTHIAZOL-FUSED 2-AMINOINDANS AND 2-AMINOTETRALINS AND THEIR USE WIKSTRÖM, Hakan Vilhelm (NL) 2001-04-18 EP disclosed
WO-2000001680-A1 NEW 2-AMINOTHIAZOL-FUSED 2-AMINOINDANS AND 2-AMINOTETRALINS AND THEIR USE WIKSTROEM HAKAN VILHELM (NL) 2000-01-13 WO disclosed
US-5618814-A Trisubstituted pyrimido [5,4-d] pyrimidines for modulating multi-drug resistance and pharmaceutical compositions containing these compounds DR. KARL THOMAE GMBH (DE) 1997-04-08 US disclosed
EP-0645390-A1 Trisubstituted pyrimido 5,4-d pyrimidines for modulating multidrug resistance, drugs containing these compounds and processes for their preparation Dr. Karl Thomae GmbH (DE) 1995-03-29 EP disclosed
US-4697018-A CARBONLESS DUPLICATION OR THERMAL MARKING DYES THE HILTON-DAVIS CHEMICAL CO. (US) 1987-09-29 US disclosed
US-4688059-A 3-ARYL(OR HETEROARYL)-3-(OXY OR THIO)PHTHALIDE AS REAGENT IN CARBONLESS DUPLICATING SYSTEM THE HILTON-DAVIS CHEMICAL CO. (US) 1987-08-18 US disclosed
US-4661605-A CARBONLESS CUPLICATION AND THERMAL MARKING SYSTEMS THE HILTON-DAVIS CHEMICAL CO. (US) 1987-04-28 US disclosed
US-4558137-A CHROMAGENS, PRESSURE AND HEAT SENSITIVE CARBONLESS DUPLICATING SYSTEMS THE HILTON-DAVIS CHEMICAL CO. (US) 1985-12-10 US disclosed
US-4535172-A FOR CARBONLESS DUPLICATING AND THERMAL MARKING SYSTEMS THE HILTON-DAVIS CHEMICAL CO. (US) 1985-08-13 US disclosed
US-4528136-A Process for preparing 2-[bis(aryl)methyl]benzoic acids THE HILTON-DAVIS CHEMICAL CO. (US) 1985-07-09 US disclosed
US-4403791-A Carbonless duplicating and marking systems STERLING DRUG INC. (US) 1983-09-13 US disclosed
US-4399291-A CONDENSATION OF A BENZALDEHYDE, AN ANILINE, AN AMINOBENZOIC ACID; OXIDATION STERLING DRUG INC. (US) 1983-08-16 US disclosed
EP-0082394-A2 A process for the production of aminophthalides and amino benzoic acids STERLING DRUG INC. (US) 1983-06-29 EP disclosed