SCHEMBL28289372

SCHEMBL28289372

O=C(c1cc[c]cc1)C1COCCN1

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSC P53634 1/20 0.38

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
SCHEMBL7288149 0.84 EPHX1 (0.39) CTSC
SCHEMBL28061949 0.81 CTSC (0.33) CTSC
SCHEMBL12858057 0.81 LMNA (0.40) CTSC
SCHEMBL6922149 0.80 MEN1 (0.35)
SCHEMBL27450889 0.79 CTSC (0.35) CTSC
SCHEMBL743847 0.76 ELANE (0.42) CTSC
SCHEMBL11485832 0.74 ALDH1A1 (0.42)
Fluoride SCHEMBL11483972 0.74 ALDH1A1 (0.42)
SCHEMBL7289268 0.73 HTR2C (0.38) CTSC
SCHEMBL25251891 0.72 POLB (0.41)

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
CN-105503903-B The Preparation Method And Their Intermediate and crystal form of benzoxazoles and oxazines ketone compounds 华北制药集团新药研究开发有限责任公司 2019-04-26 CN disclosed