SCHEMBL218868

SCHEMBL218868

CCCCN(CC)CCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 11/20 0.44
KDM5A P29375 1/20 0.42
KDM4C Q9H3R0 1/20 0.42
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA9 Q16790 2/20 0.41
PLA2G1B P04054 1/20 0.39
PLA2G2A P14555 1/20 0.39
CHRM2 P08172 1/20 0.39
HTR1A P08908 1/20 0.39
ADRA2A P08913 1/20 0.39
CHRM1 P11229 1/20 0.39
DRD1 P21728 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
ADRA1A P35348 1/20 0.39
OPRM1 P35372 1/20 0.39
DRD3 P35462 1/20 0.39
SLC6A3 Q01959 1/20 0.39
HTR1D P28221 1/20 0.38

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
SCHEMBL25644782 0.97 KCNH2 (0.42) KCNH2KDM5AKDM4CCA12CA1
Hydrochloric Acid SCHEMBL22771657 0.97 KCNH2 (0.42) KCNH2KDM5AKDM4CCA12CA1
SCHEMBL217114 0.94 KCNH2 (0.47) KCNH2KDM5AKDM4CCA12CA1
SCHEMBL24155985 0.92 KCNH2 (0.40) KCNH2KDM5AKDM4CCA12CA1
SCHEMBL2874914 0.91 KCNH2 (0.50) KCNH2KDM5AKDM4CPLA2G1BPLA2G2A
SCHEMBL1817800 0.90 KCNH2 (0.43) KCNH2KDM5AKDM4CPLA2G1BPLA2G2A
Hydrochloric Acid SCHEMBL22771631 0.90 KCNH2 (0.45) KCNH2KDM5AKDM4CCA12CA1
SCHEMBL10879676 0.88 KCNH2 (0.53) KCNH2PLA2G1BPLA2G2A
Hydrochloric Acid SCHEMBL22771831 0.88 KCNH2 (0.48) KCNH2KDM5AKDM4CPLA2G1BPLA2G2A
SCHEMBL20299290 0.88 KCNH2 (0.53) KCNH2PLA2G1BPLA2G2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5731128-A ELASTICITY, HARDNESS, ELONGATION; WATER DEVELOPABILITY NIPPON PAINT CO., LTD. (JP) 1998-03-24 US claimed
US-4410730-A Process for the production of o-(N-monosubstituted amino)benzyl alcohols SHIONOGI & CO., LTD. (JP) 1983-10-18 US claimed
WO-2023205074-A1 PROCESSES AND INTERMEDIATES FOR SYNTHESIS OF ADAGRASIB Mirati Therapeutics, Inc. (US) 2023-10-26 WO disclosed
CN-110475748-B Method for producing titanium-containing silicon oxide, method for producing epoxide, and titanium-containing silicon oxide 住友化学株式会社 2022-12-30 CN disclosed
EP-2384457-B1 COATING COMPOSITIONS MERCK PATENT GMBH (DE) 2022-07-06 EP disclosed
WO-2022094012-A1 MACROCYCLIC UREA OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME CORP. (US) 2022-05-05 WO disclosed
CN-110475748-A The Si oxide of the manufacturing method of the Si oxide of titaniferous, the manufacturing method of epoxides and titaniferous SUMITOMO CHEMICAL CO 2019-11-19 CN disclosed
EP-3479693-A1 SULFIDE CONTAINING POLYESTER COATINGS FOR AGROCHEMICAL COMPOSITION Everris International B.V. (NL) 2019-05-08 EP disclosed
WO-2019036384-A1 TRICYCLIC COMPOUNDS AS HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. (US) 2019-02-21 WO disclosed
CN-107405617-A Anion exchange membrane, electrochemical element and electrochemical device having the same 日东电工株式会社 2017-11-28 CN disclosed
CN-107406534-A Ionomer resin, ionomer solution containing the ionomer resin, laminate, member, electrochemical element, and electrochemical device 日东电工株式会社 2017-11-28 CN disclosed
US-4867754-A ADDING PHOSPHITE AND TERTIARY AMINE BETZ LABORATORIES, INC. (US) 1989-09-19 US disclosed
EP-0206621-A1 Process for disproportionating silanes MITSUI TOATSU CHEMICALS, Inc. (JP) 1986-12-30 EP disclosed
EP-0107120-B1 SUBSTITUTED AMINOALCANOL PHOSPHOLIPIDS AND PROCESS FOR THEIR PREPARATION A. Nattermann & Cie. GmbH (DE) 1986-10-29 EP disclosed
EP-0121088-B1 NEW O-ACYL-ALKANEDIOL-PHOSPHOLIPIDS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM A. Nattermann & Cie. GmbH (DE) 1986-10-01 EP disclosed
US-4610979-A O-acyl-alkanediol-phospholipids and processes for the treatment of asthma A. NATTERMANN & CIE GMBH (DE) 1986-09-09 US disclosed
US-4565659-A Substituted aminoalkanol phospholipids A. NATTERMANN & CIE GMBH (DE) 1986-01-21 US disclosed
EP-0121088-A1 New o-acyl-alkanediol-phospholipids, processes for their preparation and pharmaceutical preparations containing them A. Nattermann & Cie. GmbH (DE) 1984-10-10 EP disclosed
EP-0107120-A1 Substituted aminoalcanol phospholipids and process for their preparation A. Nattermann & Cie. GmbH (DE) 1984-05-02 EP disclosed
US-4410730-A Process for the production of o-(N-monosubstituted amino)benzyl alcohols SHIONOGI & CO., LTD. (JP) 1983-10-18 US disclosed