SCHEMBL7360792

SCHEMBL7360792

NC1CC(=O)Oc2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.43
MAPT P10636 7/20 0.43
MEN1 O00255 6/20 0.43
KMT2A Q03164 6/20 0.43
HPGD P15428 3/20 0.43
GAA P10253 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ATM Q13315 1/20 0.43
TDP1 Q9NUW8 2/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
USP2 O75604 1/20 0.40
THRB P10828 1/20 0.40
ALDH2 P05091 1/20 0.40
CYP2C9 P11712 1/20 0.40
RECQL P46063 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
Hydrochloric Acid SCHEMBL6782851 0.98 ALDH1A1 (0.42) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL21847060 0.77 MAOA (0.50) MAPTMEN1KMT2AGAAATM
SCHEMBL9534932 0.77 MAOA (0.41) MAPTMEN1KMT2AATMMAOA
SCHEMBL14047016 0.77 ALDH1A1 (0.47) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL7113968 0.77 MAOA (0.50) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL15047842 0.77 ALDH1A1 (0.43) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL8080906 0.77 ALDH1A1 (0.47) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL10531163 0.77 ALDH1A1 (0.43) ALDH1A1MAPTMEN1KMT2AHPGD
Hydrochloric Acid SCHEMBL6776863 0.76 MAOA (0.39) MAPTMEN1KMT2AATMMAOA
SCHEMBL12200287 0.74 ALDH1A1 (0.68) ALDH1A1MAPTMEN1KMT2AHPGD

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7332509-B2 Heterocyclic amides, a process for their preparation, compositions comprising them and their use MERIAL LIMITED (US) 2008-02-19 US disclosed
US-7332509-B2 Heterocyclic amides, a process for their preparation, compositions comprising them and their use MERIAL LIMITED (US) 2008-02-19 US disclosed
EP-1434485-B1 NICOTINIC ACID-HETEROCYCLYL-AMIDES AND ANALOGOUS PYRIMIDINE DERIVATIVES FOR USE AS PESTICIDES MERIAL LTD (US) 2007-05-16 EP disclosed
US-6037365-A ANTIINFLAMMATORY AND ANTIMETASTASIS AGENTS; CARDIOVASCULAR DISORDERS, ARTERIOSCLEROSIS G.D. SEARLE & CO. (US) 2000-03-14 US disclosed
US-5441974-A Phenyl amidines lactones useful as platelet aggregation inhibitors G. D. SEARLE & CO. (US) 1995-08-15 US disclosed
WO-1993012103-A1 PHENYL AMIDINES LACTONES USEFUL AS PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1993-06-24 WO disclosed