SCHEMBL991990

SCHEMBL991990

CCCc1ccccc1C(N)(CCC)CCC

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.32
TAAR1 Q96RJ0 1/20 0.31
AR P10275 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
ADRA2A P08913 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 1/20 0.30
GABRA1 P14867 1/20 0.30
GABRB2 P47870 1/20 0.30
HTR1A P08908 1/20 0.30

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
Water SCHEMBL8529338 0.98 AR (0.33) IDO1TAAR1ARLIPGSLC6A2
Hydrochloric Acid SCHEMBL623059 0.98 IDO1 (0.33) IDO1TAAR1ARLIPGSLC6A2
SCHEMBL7630859 0.90 GABRA1 (0.32) ARGABRA1GABRB2
Hydrochloric Acid SCHEMBL8530475 0.85 GABRA1 (0.39) IDO1GABRA1GABRB2
Water SCHEMBL8530426 0.85 GABRA1 (0.39) IDO1SLC6A2SLC6A4GABRA1GABRB2
SCHEMBL2317717 0.85 IDO1 (0.32) IDO1TAAR1ARLIPGSLC6A2
SCHEMBL28661100 0.84 GABRA1 (0.31) GABRA1GABRB2
SCHEMBL331681 0.81 LIPG (0.40) LIPGSLC6A2SLC6A4
Water SCHEMBL187670 0.80 LIPG (0.39) LIPGSLC6A2SLC6A4
Iodide SCHEMBL21808913 0.80 LIPG (0.39) LIPGSLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0249556-B1 PROCESS FOR THE PREPARATION OF ALPHA-HALOGENATED ORGANIC ESTERS OF CARBONIC ACID SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1990-08-29 EP claimed
EP-0249556-A1 Process for the preparation of alpha-halogenated organic esters of carbonic acid SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1987-12-16 EP claimed
US-6384179-B1 None US disclosed
CN-109385036-B Polyoxymethylene resin composition and molded article 旭化成株式会社 2022-10-04 CN disclosed
CN-109385037-B Polyoxymethylene resin composition 旭化成株式会社 2022-10-04 CN disclosed
CN-109679275-B Polyacetal resin composition 旭化成株式会社 2022-03-01 CN disclosed
EP-3492450-B1 QUATERNARY AMMONIUM COMPOUND AND SUPPRESSION OF GENERATION OF VOLATILE ORGANIC COMPOUND FROM POLYACETAL UTILIZING SAME ASAHI CHEMICAL IND (JP) 2021-10-13 EP disclosed
CN-109563025-B Quaternary ammonium compound and suppression of formation of volatile organic compound derived from polyacetal by using same 旭化成株式会社 2021-07-23 CN disclosed
US-10815190-B2 Quaternary ammonium compound, and agent for suppression of generation of volatile organic compound from polyacetal by use of the same ASAHI KASEI KABUSHIKI KAISHA (JP) 2020-10-27 US disclosed
EP-3492450-A1 QUATERNARY AMMONIUM COMPOUND AND SUPPRESSION OF GENERATION OF VOLATILE ORGANIC COMPOUND FROM POLYACETAL UTILIZING SAME ASAHI KASEI KABUSHIKI KAISHA (JP) 2019-06-05 EP disclosed
US-20190161433-A1 QUATERNARY AMMONIUM COMPOUND, AND AGENT FOR SUPPRESSION OF GENERATION OF VOLATILE ORGANIC COMPOUND FROM POLYACETAL BY USE OF THE SAME ASAHI KASEI KABUSHIKI KAISHA (JP) 2019-05-30 US disclosed
US-20050018353-A1 Ramp for hard disc ASAHI KASEI KABUSHIKI KAISHA (JP) 2005-01-27 US disclosed
US-6384179-B2 COMPRISES 30-90% BY WEIGHT OF POLYACETAL COPOLYMER HAVING A MELT INDEX OF LESS THAN 1 G/10 MIN. AS COMPONENT A AND 70-10% BY WEIGHT OF POLYACETAL COPOLYMER HAVING A MELT INDEX OF 1-100 G/10 MIN. AS COMPONENT B; TOUGHNESS, CREEP RESISTANCE ASAHI KASEI KABUSHIKI KAISHA (JP) 2002-05-07 US disclosed
US-6365655-B1 SUBJECTING AN OXYMETHYLENE COPOLYMER HAVING THERMALLY UNSTABLE TERMINAL GROUPS TO HEAT TREATMENT IN THE PRESENCE OF AT LEAST ONE QUATERNARY AMMONIUM COMPOUND FOR STABILIZATION ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2002-04-02 US disclosed
US-20010007006-A1 Polyacetal resin composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2001-07-05 US disclosed
US-5043459-A Saccharoascorbic acid derivatives and production thereof TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-08-27 US disclosed
EP-0249556-B1 PROCESS FOR THE PREPARATION OF ALPHA-HALOGENATED ORGANIC ESTERS OF CARBONIC ACID SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1990-08-29 EP disclosed
WO-1988010257-A1 SACCHAROASCORBIC ACID ESTERS, PRODUCTION AND USE THEREOF TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-12-29 WO disclosed
EP-0295842-A1 Saccharoascorbic acid esters, production and use thereof Takeda Chemical Industries, Ltd. (JP) 1988-12-21 EP disclosed
EP-0249556-A1 Process for the preparation of alpha-halogenated organic esters of carbonic acid SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1987-12-16 EP disclosed