SCHEMBL19967010

SCHEMBL19967010

CCOC(=O)C1CCN([C@@](C)(C=N)C(C)C)CC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.49
ALDH1A1 P00352 8/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
TSHR P16473 1/20 0.46
GAA P10253 3/20 0.44
HTT P42858 2/20 0.42
PKM P14618 1/20 0.42
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KDM4E B2RXH2 3/20 0.41
LIPE Q05469 1/20 0.40

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
SCHEMBL19967009 0.87 MAPT (0.45) MAPTALDH1A1MEN1KMT2ATSHR
SCHEMBL8260610 0.81 MAPT (0.58) MAPTALDH1A1MEN1KMT2ATSHR
SCHEMBL19967012 0.80 LMNA (0.41) MAPTKMT2ATSHRCYP2C19KDM4E
SCHEMBL25609417 0.75 MAPT (0.51) MAPTALDH1A1MEN1KMT2ATSHR
SCHEMBL5520122 0.73 MAPT (0.60) MAPTALDH1A1MEN1KMT2ATSHR
SCHEMBL27629749 0.73 MAPT (0.57) MAPTALDH1A1MEN1KMT2ATSHR
SCHEMBL741956 0.71 MAPT (0.61) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL18914421 0.71 MAPT (0.57) MAPTALDH1A1MEN1KMT2ATSHR
SCHEMBL17282166 0.70 MAPT (0.50) MAPTALDH1A1MEN1KMT2ATSHR
SCHEMBL5701048 0.70 ALDH1A1 (0.55) MAPTALDH1A1MEN1KMT2ATSHR

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
WO-2018045907-A1 NOVEL 2-ACYLAMINOTHIAZOLE DERIVATIVE AND PREPARATION METHOD THEREFOR AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2018-03-15 WO disclosed