SCHEMBL346989

SCHEMBL346989

CCCC[N+](CC)(CCCC)CCCC

nearest known ligand 0.73

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 3/20 0.73
DNM1 Q05193 5/20 0.67
SLC22A2 O15244 1/20 0.62
TSHR P16473 2/20 0.56
ALDH1A1 P00352 1/20 0.56
TP53 P04637 1/20 0.56
CYP3A4 P08684 1/20 0.56
ALOX15 P16050 1/20 0.56
ALOX12 P18054 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
HIF1A Q16665 1/20 0.56
HSD17B10 Q99714 1/20 0.56
NFKB1 P19838 1/20 0.47
KCNA1 Q09470 1/20 0.47
KDM4E B2RXH2 1/20 0.44
PMP22 Q01453 1/20 0.44
ATM Q13315 1/20 0.44

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 SCHEMBL1332993 0.97 SLC22A1 (0.69) SLC22A1DNM1SLC22A2TSHRALDH1A1
Iodide SCHEMBL4333792 0.97 SLC22A1 (0.69) SLC22A1DNM1SLC22A2TSHRALDH1A1
SCHEMBL10598482 0.97 SLC22A1 (0.69) SLC22A1DNM1SLC22A2TSHRALDH1A1
SCHEMBL10598485 0.97 SLC22A1 (0.69) SLC22A1DNM1SLC22A2TSHRALDH1A1
Bromide SCHEMBL3680180 0.97 SLC22A1 (0.69) SLC22A1DNM1SLC22A2TSHRALDH1A1
Hydrochloric Acid SCHEMBL5084823 0.97 SLC22A1 (0.69) SLC22A1DNM1SLC22A2TSHRALDH1A1
SCHEMBL11806867 0.94 DNM1 (0.78) SLC22A1DNM1SLC22A2TSHRALDH1A1
SCHEMBL16649092 0.94 DNM1 (0.78) SLC22A1DNM1SLC22A2TSHRALDH1A1
SCHEMBL5354508 0.94 SLC22A1 (0.65) SLC22A1DNM1SLC22A2TSHRALDH1A1
SCHEMBL5353514 0.94 SLC22A1 (0.65) SLC22A1DNM1SLC22A2TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12252632-B2 Chemical-mechanical polishing composition, rinse composition, chemical- mechanical polishing method, and rinsing method ENTEGRIS, INC. (US) 2025-03-18 US claimed
CN-119431409-A Bipyridine coordinated catalyst, preparation method, composite catalyst and application 上海元革新材料科技有限公司 2025-02-14 CN claimed
EP-4423087-A1 SYNTHESIS OF [1,2,3]TRIAZOLO[4,5-D]PYRIMIDINES F. Hoffmann-La Roche AG (CH) 2024-09-04 EP claimed
WO-2024165361-A1 PREPARATION OF POLYISOCYANATES CONTAINING IMINOOXADIAZINEDIONE GROUPS AND THEIR USE BASF SE (DE) 2024-08-15 WO claimed
CN-118076608-A Synthesis of [1,2,3] triazolo [4,5-D ] pyrimidine 豪夫迈·罗氏有限公司 2024-05-24 CN claimed
WO-2024004511-A1 SOLVENT TO BE USED FOR DISSOLVING POLYSACCHARIDE, SOLUTION OF POLYSACCHARIDE, AND METHOD FOR PRODUCING MOLDED BODY OF POLYSACCHARIDE USING SAME 旭化成株式会社 2024-01-04 WO claimed
WO-2023138938-A1 PREPARATION OF POLYISOCYANATES CONTAINING IMINOOXADIAZINEDIONE GROUPS AND THEIR USE BASF SE (DE) 2023-07-27 WO claimed
EP-4208500-A1 POLYMERS CONTAINING REPEATING UNITS WITH SEVERAL METAL OR ORGANIC SULPHONATE UNITS, METHODS FOR PREPARING SAME AND USES THEREOF CDP-Innovation (FR) 2023-07-12 EP claimed
WO-2023072978-A1 SYNTHESIS OF [1,2,3]TRIAZOLO[4,5-D]PYRIMIDINES F. HOFFMANN-LA ROCHE AG (CH) 2023-05-04 WO claimed
US-20220372329-A1 CHEMICAL-MECHANICAL POLISHING COMPOSITION, RINSE COMPOSITION, CHEMICAL-MECHANICAL POLISHING METHOD, AND RINSING METHOD ENTEGRIS, INC. 2022-11-24 US claimed
CN-1009042-B SECONDARY CELL SHOWA DENKO KK (JP) 1990-08-01 CN claimed
US-4789442-A ELECTROHYDRODIMERIZATION OF ACRYLONITRILE; CORROSION RESISTANCE ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1988-12-06 US claimed
US-4786429-A QUATERNARY AMMONIUM SALT IN A BUTYROLACTONE SOLVENT MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1988-11-22 US claimed
EP-0141371-B1 SECONDARY BATTERY SHOWA DENKO KABUSHIKI KAISHA (JP) 1988-08-10 EP claimed
EP-0270390-A2 A method for producing adiponitrile Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1988-06-08 EP claimed
CN-85103100-A SECONDARY CELL 1987-08-19 CN claimed
EP-0185240-A2 Process for the preparation of N-substituted benz[c,d]indol-2-ones BAYER AG (DE) 1986-06-25 EP claimed
US-4537843-A ELECTRODES OF POLYMER WITH CONJUGATED DOUBLE BONDS IN MAIN CHAIN, SHOWA DENKO KABUSHIKI KAISHA (JP) 1985-08-27 US claimed
EP-0141371-A1 Secondary Battery SHOWA DENKO KABUSHIKI KAISHA (JP) 1985-05-15 EP claimed
US-4225498-A Preparation of N-substituted oligo-imides RHONE-POULENC INDUSTRIES (FR) 1980-09-30 US claimed