SCHEMBL9125751

SCHEMBL9125751

Fc1ccccc1COc1cccnc1NC(=S)Nc1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPIA P62937 6/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
MAPT P10636 3/20 0.54
PKM P14618 2/20 0.54
LMNA P02545 1/20 0.54
CRHBP P24387 1/20 0.54
CRHR2 Q13324 1/20 0.54
FNTA P49354 1/20 0.47
FNTB P49356 1/20 0.47
PPIF P30405 1/20 0.46
SGMS2 Q8NHU3 2/20 0.45
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 1/20 0.45
ESR1 P03372 1/20 0.45
TP53 P04637 1/20 0.45
GAA P10253 1/20 0.45
THRB P10828 1/20 0.45
ALOX12 P18054 1/20 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
SCHEMBL9125540 0.89 PPIA (0.50) PPIASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL9126341 0.89 PPIA (0.56) PPIASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL9125551 0.88 PPIA (0.53) PPIASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL9123466 0.87 PPIA (0.50) PPIASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL9126340 0.87 PPIA (0.54) PPIASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL9123692 0.86 PPIA (0.49) PPIASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL9124294 0.85 PPIA (0.50) PPIASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL9125562 0.85 PPIA (0.46) PPIASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL9126812 0.85 PPIA (0.52) PPIASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL9126145 0.84 PPIA (0.75) PPIAMEN1KMT2AMAPTPPIF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5409943-A [(alkoxy)pyridinyl]amine compounds which are useful in the treatment of gastrointestinal disorders SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) 1995-04-25 US disclosed
EP-0625143-A1 PYRIDINE DERIVATIVES, THEIR PREPARATION AND USE AS MEDICINES SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) 1994-11-23 EP disclosed
WO-1993015055-A1 PYRIDINE DERIVATIVES, THEIR PREPARATION AND USE AS MEDICINES SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) 1993-08-05 WO disclosed