SCHEMBL8181543

SCHEMBL8181543

O=C1NC(=S)OC1=CC=CC=Cc1ccco1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 2/20 0.56
▸ MEN1 O00255 10/20 0.48
▸ KMT2A Q03164 10/20 0.48
▸ RECQL P46063 10/20 0.48
▸ MAPT P10636 10/20 0.48
▸ APEX1 P27695 3/20 0.48
▸ KDM4E B2RXH2 3/20 0.48
▸ ALPL P05186 1/20 0.48
▸ ALPI P09923 1/20 0.48
▸ ALPG P10696 1/20 0.48
▸ DUSP3 P51452 1/20 0.44
▸ TDP1 Q9NUW8 4/20 0.43
▸ MAPK1 P28482 6/20 0.43
▸ NPSR1 Q6W5P4 5/20 0.43
▸ MITF O75030 5/20 0.43
▸ PKM P14618 3/20 0.43
▸ GFER P55789 2/20 0.43
▸ POLB P06746 7/20 0.42
▸ L3MBTL1 Q9Y468 7/20 0.42
▸ ALDH1A1 P00352 6/20 0.42

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
SCHEMBL8181542 1.00 F2 (0.56) F2MEN1KMT2ARECQLMAPT
SCHEMBL8172539 0.94 F2 (0.62) F2MEN1KMT2ARECQLMAPT
SCHEMBL8190580 0.75 POLB (0.57) F2MEN1KMT2ARECQLMAPT
SCHEMBL8190582 0.75 POLB (0.57) F2MEN1KMT2ARECQLMAPT
SCHEMBL1065724 0.71 F2 (1.00) F2MEN1KMT2ARECQLMAPT
SCHEMBL1704746 0.71 F2 (1.00) F2MEN1KMT2ARECQLMAPT
SCHEMBL13024523 0.71 F2 (1.00) F2MEN1KMT2ARECQLMAPT
SCHEMBL8182589 0.70 GSK3B (0.43) —
SCHEMBL8182951 0.70 PIM1 (0.48) F2MAPTKDM4ETDP1MAPK1
SCHEMBL9298131 0.70 F2 (0.67) F2MEN1KMT2ARECQLMAPT

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-2000018745-A1 OXAZOLIDINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF METABOLIC BONE DISORDERS ROCHE DIAGNOSTICS GMBH (DE) 2000-04-06 — — WO disclosed
Send feedback