SCHEMBL11537460

SCHEMBL11537460

CCOC(=O)C(=O)Nc1cccc(C)n1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.63
KMT2A Q03164 3/20 0.63
RAB9A P51151 7/20 0.60
NPC1 O15118 6/20 0.57
TP53 P04637 4/20 0.57
MAPT P10636 4/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
LMNA P02545 2/20 0.57
PKM P14618 1/20 0.57
GBA1 P04062 3/20 0.56
GPR35 Q9HC97 1/20 0.55
GRM5 P41594 1/20 0.54
TSHR P16473 1/20 0.53
CHRNB2 P17787 1/20 0.51
CHRNB4 P30926 1/20 0.51
CHRNA3 P32297 1/20 0.51
CHRNA4 P43681 1/20 0.51
HSD17B10 Q99714 1/20 0.51

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
SCHEMBL11728624 0.92 GPR35 (0.59) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL18415550 0.85 RAB9A (0.66) MEN1KMT2ARAB9ANPC1TP53
SCHEMBL16429429 0.80 RAB9A (0.58) MEN1KMT2ARAB9ANPC1TP53
SCHEMBL11098704 0.79 GPR35 (0.46) MEN1KMT2ARAB9ANPC1TP53
SCHEMBL11538222 0.78 NPC1 (0.64) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL1023541 0.78 MEN1 (1.00) MEN1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL16428759 0.78 TSHR (0.62) MEN1KMT2ARAB9ANPC1TP53
SCHEMBL10444695 0.78 NPC1 (0.55) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL8240316 0.77 RAB9A (0.71) MEN1KMT2ARAB9ANPC1TP53
SCHEMBL2144418 0.77 KMT2A (0.62) MEN1KMT2ARAB9ANPC1TP53

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
US-4054661-A Pyridyl oxamic acid derivatives and use in the prevention of allergic reactions AMERICAN HOME PRODUCTS CORPORATION (US) 1977-10-18 US claimed
US-4160100-A OXAMIC ACID DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION (US) 1979-07-03 US disclosed
US-4054661-A Pyridyl oxamic acid derivatives and use in the prevention of allergic reactions AMERICAN HOME PRODUCTS CORPORATION (US) 1977-10-18 US disclosed
US-4054657-A Pyrimidinyl oxamic acids and esters, and compositions and methods for the suppression of allergic manifestations AMERICAN HOME PRODUCTS CORPORATION (US) 1977-10-18 US disclosed
US-4054666-A Compositions and methods of treating immediate hypersensitivity reactions with thiazolyl oxamic acid derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1977-10-18 US disclosed
US-4036837-A 2 Alkoxyoxamoyl-pyrazines AMERICAN HOME PRODUCTS CORPORATION (US) 1977-07-19 US disclosed
US-3966965-A Oxamic acid derivatives for the prevention of immediate type hypersensitivity reactions AMERICAN HOME PRODUCTS CORPORATION (US) 1976-06-29 US disclosed