SCHEMBL10322111

SCHEMBL10322111

CCC(=O)c1cc(C(C)(C)C)cc(N)c1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 2/20 0.41
ALDH1A1 P00352 2/20 0.41
GAA P10253 1/20 0.41
PKM P14618 1/20 0.41
RECQL P46063 1/20 0.41
NR5A2 O00482 1/20 0.40
NR5A1 Q13285 1/20 0.40
HSP90AB1 P08238 2/20 0.39
HSP90AA1 P07900 2/20 0.39
HMGCR P04035 1/20 0.37
KDM4E B2RXH2 2/20 0.35
UBE2N P61088 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
CYP2C19 P33261 1/20 0.35
CHEK1 O14757 1/20 0.35
FYN P06241 1/20 0.35

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 SCHEMBL11289618 0.98 NR5A2 (0.40) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL11289849 0.87 ALDH1A1 (0.45) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL11288335 0.84 NR5A2 (0.46) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL11291145 0.83 HTT (0.46) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL11294355 0.82 PLA2G2A (0.47) MEN1KMT2AMAPTALDH1A1NR5A2
SCHEMBL11291778 0.81 NR5A2 (0.37) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL5344407 0.81 NR5A2 (0.58) KMT2AALDH1A1GAARECQLNR5A2
Hydrochloric Acid SCHEMBL11288203 0.81 PLA2G2A (0.46) MEN1KMT2AMAPTALDH1A1NR5A2
SCHEMBL11307428 0.81 MIF (0.40) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL11289049 0.81 MEN1 (0.44) MEN1KMT2AMAPTALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0065874-A1 2-Aminophenol derivatives, methods for their preparation and composition containing the same ONO PHARMACEUTICAL CO., LTD. (JP) 1982-12-01 EP claimed
JP-57193428-A None JP disclosed
WO-2014176460-A1 METHODS OF TREATING BEHAVIORIAL AND/OR MENTAL DISORDERS CHAU DAVID T (US) 2014-10-30 WO disclosed
US-8486922-B2 Composition CHEN CHIEN-HUNG (TW) 2013-07-16 US disclosed
US-20120183600-A1 NOVEL COMPOSITION FOR TREATING METABOLIC SYNDROME AND OTHER CONDITIONS CHEN CHIEN-HUNG (US) 2012-07-19 US disclosed
EP-0065874-A1 2-Aminophenol derivatives, methods for their preparation and composition containing the same ONO PHARMACEUTICAL CO., LTD. (JP) 1982-12-01 EP disclosed
JP-S57193428-A 2-ACYL-6-AMINOPHENOL DERIVATIVE, ITS PREPARATION, AND REMEDY FOR DISEASES CAUSED BY LEUCOTRIENE CONTAINING THE SAME ONO PHARMACEUT CO LTD 1982-11-27 JP disclosed