SCHEMBL599237

SCHEMBL599237

CCCCN(CCCC)CCCC.CCN(CC)CC

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA9 Q16790 2/20 0.42
PLA2G1B P04054 1/20 0.41
PLA2G2A P14555 1/20 0.41
KCNH2 Q12809 6/20 0.41
KDM5A P29375 2/20 0.39
KDM4C Q9H3R0 1/20 0.39
MAPT P10636 1/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 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
Ammonia Solution, Strong SCHEMBL28160549 0.97 CA12 (0.41) CA12CA1CA9PLA2G1BPLA2G2A
Trimethylammonium SCHEMBL7168741 0.94 CA12 (0.39) CA12CA1CA9PLA2G1BPLA2G2A
SCHEMBL217114 0.90 KCNH2 (0.47) CA12CA1CA9PLA2G1BPLA2G2A
SCHEMBL22725 0.90
SCHEMBL27566038 0.89 TSHR (0.46) CA12CA1CA9KDM5AKDM4C
SCHEMBL896 0.89 TSHR (0.46) CA12CA1CA9KDM5AKDM4C
SCHEMBL3904839 0.89 TSHR (0.46) CA12CA1CA9KDM5AKDM4C
Phosphine SCHEMBL27856383 0.87 CA12 (0.42) CA12CA1CA9PLA2G1BPLA2G2A
Hydrochloric Acid SCHEMBL22771631 0.87 KCNH2 (0.45) CA12CA1CA9PLA2G1BPLA2G2A
Hydrochloric Acid SCHEMBL20494118 0.87 CA12 (0.42) CA12CA1CA9PLA2G1BPLA2G2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0740685-A4 NON-OZONE DEPLETING CO-SOLVENT COMPOSITIONS LOCTITE CORP (US) 1998-01-07 EP claimed
EP-0740685-A1 NON-OZONE DEPLETING CO-SOLVENT COMPOSITIONS LOCTITE CORPORATION (US) 1996-11-06 EP claimed
WO-1996011979-A1 NON-OZONE DEPLETING CO-SOLVENT COMPOSITIONS LOCTITE CORPORATION (US) 1996-04-25 WO claimed
US-5260449-A Method for preparing 7-oxabicycloheptyl substituted bromooxazole amide prostaglandin analog intermediates useful in the preparation of anti-thrombotic and anti-vasospastic compounds E. R. SQUIBB & SONS, INC. (US) 1993-11-09 US claimed
EP-0186803-A2 Diacylderivatives of glycerylphosphorylcholine having therapeutical activity, a process for their preparation and related pharmaceutical compositions NEOPHARMED S.p.A. (IT) 1986-07-09 EP claimed
US-20230216086-A1 ELECTROLYTES FOR TARGET ION TRANSPORT MONASH UNIVERSITY (AU) 2023-07-06 US disclosed
EP-4149923-A1 ELECTROLYTES FOR TARGET ION TRANSPORT Deakin University (AU) 2023-03-22 EP disclosed
WO-2021226675-A1 ELECTROLYTES FOR TARGET ION TRANSPORT DEAKIN UNIVERSITY (AU) 2021-11-18 WO disclosed
US-10696622-B2 Synthesis of N-vinyl carboxylic acid amides EASTMAN CHEMICAL COMPANY (US) 2020-06-30 US disclosed
EP-3504184-A1 SYNTHESIS OF 1-HYDROXYETHYL FORMAMIDES AND N-VINYL FORMAMIDES Taminco BVBA (BE) 2019-07-03 EP disclosed
US-20180118867-A1 ELLIPTICAL, NEEDLE-SHAPED, OR ROD-SHAPED CROSSLINKED POLYMER PARTICLES, AND USE THEREOF NISSHINBO HOLDINGS INC. (JP) 2018-05-03 US disclosed
WO-2018041615-A1 SYNTHESIS OF 1-HYDROXYETHYL FORMAMIDES AND N-VINYL FORMAMIDES TAMINCO BVBA (BE) 2018-03-08 WO disclosed
EP-0985696-A1 STABILIZED AROMATIC POLYCARBONATE TEIJIN LIMITED (JP) 2000-03-15 EP disclosed
WO-1999055454-A1 ENCAPSULATED ACTIVE MATERIALS THE DOW CHEMICAL COMPANY (US) 1999-11-04 WO disclosed
CN-1228782-A Process for the preparation of 17-diesters of 9 alpha, 21-dihalo-pregnane-11 beta, 17 alpha-diol-20-ones SCHERING CORP (US) 1999-09-15 CN disclosed
US-5036066-A Muscle relaxants, anxiolytic agents, anticonvulsants HOFFMANN-LA ROCHE INC. (US) 1991-07-30 US disclosed
EP-0349488-A1 Process for preparing dithiobisphenols CIBA-GEIGY AG (CH) 1990-01-03 EP disclosed
US-4863984-A STYRENE RESIN, AMINE SALT GENERAL ELECTRIC COMPANY (US) 1989-09-05 US disclosed
EP-0305861-A1 Flame retardant extrudate of polyphenylene ether blends, and method of making GENERAL ELECTRIC COMPANY (US) 1989-03-08 EP disclosed
US-4233060-A α-Phenoxy-thiolpropionic acids CIBA-GEIGY CORPORATION (US) 1980-11-11 US disclosed