SCHEMBL11064150

SCHEMBL11064150

CC(C)OC(=O)C(=O)Nc1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
SMN1; SMN2 Q16637 6/20 0.49
MAPT P10636 2/20 0.49
GAA P10253 2/20 0.49
ALDH1A1 P00352 1/20 0.49
TSHR P16473 1/20 0.47
NPC1 O15118 5/20 0.47
HPGD P15428 2/20 0.46
ALOX15 P16050 1/20 0.46
RAB9A P51151 5/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
PKM P14618 1/20 0.46
CYP19A1 P11511 1/20 0.45
HTT P42858 2/20 0.45

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
SCHEMBL11464467 0.82 SMN1; SMN2 (0.70) NPSR1SMN1; SMN2MAPTGAAALDH1A1
SCHEMBL9335595 0.82 HPGD (0.67) POLBNPSR1SMN1; SMN2MAPTALDH1A1
SCHEMBL5548239 0.82 RAB9A (0.56) POLBSMN1; SMN2MAPTGAAALDH1A1
SCHEMBL11059694 0.82 CYP19A1 (0.48) SMN1; SMN2MAPTGAANPC1RAB9A
SCHEMBL9672872 0.81 ADRA1A (0.59) POLBNPSR1SMN1; SMN2MAPTALDH1A1
Hydrochloric Acid SCHEMBL8805273 0.81 SMN1; SMN2 (0.68) NPSR1SMN1; SMN2MAPTGAAALDH1A1
SCHEMBL9521689 0.80 POLB (0.45) POLBNPSR1SMN1; SMN2MAPTALDH1A1
SCHEMBL21568080 0.77 NPC1 (0.67) POLBSMN1; SMN2MAPTGAAALDH1A1
SCHEMBL11457003 0.76 SMN1; SMN2 (0.48) POLBNPSR1SMN1; SMN2MAPTGAA
SCHEMBL1503906 0.76 ALDH1A1 (0.71) POLBSMN1; SMN2MAPTGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4483707-A PLANT SAFTENING AGENTS CIBA-GEIGY CORPORATION (US) 1984-11-20 US disclosed