SCHEMBL11294355

SCHEMBL11294355

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

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 2/20 0.47
PLA2G5 P39877 2/20 0.47
FFAR1 O14842 1/20 0.47
HTT P42858 2/20 0.44
NR5A2 O00482 1/20 0.44
NR5A1 Q13285 1/20 0.44
HSD17B3 P37058 6/20 0.41
CA2 P00918 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
STS P08842 4/20 0.37
ELANE P08246 2/20 0.37

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 SCHEMBL11288203 0.99 PLA2G2A (0.46) PLA2G2APLA2G5FFAR1HTTNR5A2
SCHEMBL11291145 0.99 HTT (0.46) PLA2G2APLA2G5FFAR1HTTNR5A2
SCHEMBL11288335 0.94 NR5A2 (0.46) PLA2G2APLA2G5FFAR1HTTNR5A2
SCHEMBL11289849 0.88 ALDH1A1 (0.45) HTTNR5A2NR5A1HSD17B3MEN1
SCHEMBL5335689 0.83 NR5A2 (0.63) PLA2G2APLA2G5FFAR1HTTNR5A2
SCHEMBL11293235 0.83 CYP1A2 (0.40) NR5A2NR5A1MEN1ALDH1A1MAPT
SCHEMBL11286999 0.82 TSHR (0.41) NR5A2NR5A1CA2MEN1ALDH1A1
SCHEMBL10322111 0.82 MEN1 (0.41) NR5A2NR5A1MEN1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL11295054 0.82 CYP1A2 (0.39) NR5A2NR5A1MEN1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL11289618 0.81 NR5A2 (0.40) NR5A2NR5A1MEN1ALDH1A1MAPT

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 2 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
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