SCHEMBL708446

SCHEMBL708446

NC(N)Cc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.70
SLC6A2 P23975 2/20 0.64
TAAR1 Q96RJ0 2/20 0.64
MAOA P21397 1/20 0.64
SLC6A4 P31645 1/20 0.64
SLC6A3 Q01959 1/20 0.64
SIGMAR1 Q99720 1/20 0.64
CYP2A6 P11509 1/20 0.64
ADORA2A P29274 1/20 0.64
ADORA1 P30542 1/20 0.64
ANPEP P15144 2/20 0.58
CYP2D6 P10635 1/20 0.58
ALPI P09923 1/20 0.56
PKM P14618 1/20 0.56
PTGS1 P23219 1/20 0.56
XIAP P98170 1/20 0.56
SLC7A5 Q01650 1/20 0.56
LAP3 P28838 3/20 0.52
SLC1A3 P43003 1/20 0.50
SLC1A2 P43004 1/20 0.50

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
Hydrochloric Acid SCHEMBL15758369 0.97 EPHX1 (0.67) EPHX1SLC6A2TAAR1MAOASLC6A4
Sulfuric Acid SCHEMBL15603173 0.86 ALPI (0.55) EPHX1SLC6A2TAAR1MAOASLC6A4
SCHEMBL22861986 0.85 TAAR1 (0.56) EPHX1SLC6A2TAAR1MAOASLC6A4
SCHEMBL9536448 0.82 EPHX1 (0.70) EPHX1SLC6A2TAAR1MAOASLC6A4
SCHEMBL28656 0.82 EPHX1 (1.00) EPHX1SLC6A2TAAR1MAOASLC6A4
SCHEMBL24017042 0.82 EPHX1 (0.70) EPHX1SLC6A2TAAR1MAOASLC6A4
Hydrochloric Acid SCHEMBL9402300 0.80 EPHX1 (0.94) EPHX1SLC6A2TAAR1MAOASLC6A4
SCHEMBL16358939 0.79 EPHX1 (0.73) EPHX1SLC6A2TAAR1MAOASLC6A4
SCHEMBL9405268 0.79 EPHX1 (0.73) EPHX1SLC6A2TAAR1MAOASLC6A4
SCHEMBL8915539 0.79 EPHX1 (0.58) EPHX1SLC6A2TAAR1MAOASLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3240821-B1 LOW DOSE GAS HYDRATE INHIBITOR COMPOSITION 
AND ASSOCIATED METHOD ECOLAB USA INC (US) 2021-03-10 EP claimed
US-9834720-B2 Low dose gas hydrate inhibitor compositions ECOLAB USA INC. (US) 2017-12-05 US claimed
EP-3240821-A1 LOW DOSE GAS HYDRATE INHIBITOR COMPOSITIONS Ecolab USA Inc. (US) 2017-11-08 EP claimed
WO-2016109388-A1 LOW DOSE GAS HYDRATE INHIBITOR COMPOSITIONS ECOLAB USA INC. (US) 2016-07-07 WO claimed
US-20160186039-A1 LOW DOSE GAS HYDRATE INHIBITOR COMPOSITIONS NORRISEAL-WELLMARK, INC. 2016-06-30 US claimed
EP-1944159-B1 NON-WOVEN FABRIC THAT ACTS AS AN INDICATOR GRUPO P I MABE SA DE C V (MX) 2014-03-26 EP claimed
US-8124546-B2 Non-woven fabric that acts as an indicator INDUSTRIAS MAQUIN S.A. DE C.V. (MX) 2012-02-28 US claimed
US-20080305700-A1 Non-Woven Fabric That Acts as an Indicator INDUSTRIAS MAQUIN S.A. DE C.V. (MX) 2008-12-11 US claimed
EP-1944159-A2 NON-WOVEN FABRIC THAT ACTS AS AN INDICATOR grupo P.I. Mabe, S.A. de C.V. (MX) 2008-07-16 EP claimed
US-5128059-A Blends of diaminoisopropylbenzene and diaminoethylbenzene FIRST CHEMICAL CORPORATION (US) 1992-07-07 US claimed
US-5049639-A Synergistic, tensile strength FIRST CHEMICAL CORPORATION (US) 1991-09-17 US claimed
WO-2024214701-A1 ADHESIVE FILM FOR CIRCUIT CONNECTION, CIRCUIT CONNECTION STRUCTURE, AND METHOD FOR PRODUCING SAME 株式会社レゾナック 2024-10-17 WO disclosed
WO-2023199326-A1 ALCOHOL ACYLTRANSFERASE AND A TRANSGENIC CELL, TISSUE, AND ORGANISM COMPRISING SAME YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2023-10-19 WO disclosed
CN-116024690-A Material for adsorbing and desorbing gold, fibrous structure and filter comprising the same, and method for recovering gold using the same 日本爱克兰工业株式会社 2023-04-28 CN disclosed
US-20220089646-A1 A CYCLIC PEPTIDE THE UNIVERSITY OF QUEENSLAND (AU) 2022-03-24 US disclosed
US-4374779-A Nitrosoamino-actonitriles AMERICAN HOME PRODUCTS CORPORATION (US) 1983-02-22 US disclosed
EP-0050916-A2 CNS stimulants and antihypertensive agents AMERICAN HOME PRODUCTS CORPORATION (US) 1982-05-05 EP disclosed
WO-1982001184-A1 SYDNONE IMINE DERIVATIVES,INTERMEDIATES THEREFORE AND METHODS OF PREPARATION AMERICAN HOME PROD (US) 1982-04-15 WO disclosed
US-4324897-A 1,2,3 Oxadiazolium salts AMERICAN HOME PRODUCTS CORPORATION (US) 1982-04-13 US disclosed
US-4289885-A 3-[2-(Dimethylamino)-2-phenylethyl]N-[phenylamino)carbonyl]sydnone imine, a new central nervous system stimulant AMERICAN HOME PRODUCTS CORPORATION (US) 1981-09-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220089646-A1 A CYCLIC PEPTIDE VIP, CALCA, CALCB EPHX1 3702/4885SLC6A2 3968/4885TAAR1 3466/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.