SCHEMBL526977

SCHEMBL526977

O=C(CCN1CCc2ccccc21)OCc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.67
MAPT P10636 5/20 0.66
MEN1 O00255 4/20 0.66
KMT2A Q03164 4/20 0.66
L3MBTL1 Q9Y468 3/20 0.66
KDM4E B2RXH2 2/20 0.66
POLB P06746 1/20 0.66
TDP1 Q9NUW8 1/20 0.66
NPC1 O15118 5/20 0.60
RAB9A P51151 5/20 0.60
ALDH1A1 P00352 7/20 0.54
USP2 O75604 1/20 0.54
CDK4 P11802 1/20 0.54
ALOX15 P16050 1/20 0.54
CCND1 P24385 1/20 0.54
TMEM97 Q5BJF2 2/20 0.49
SIGMAR1 Q99720 2/20 0.49
CHRM2 P08172 3/20 0.49
CHRM4 P08173 3/20 0.49
CHRM1 P11229 3/20 0.49

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
SCHEMBL14495647 0.86 NOTUM (0.63) NOTUMMAPTMEN1KMT2AL3MBTL1
SCHEMBL22248030 0.84 NOTUM (0.66) NOTUMMAPTMEN1KMT2AL3MBTL1
SCHEMBL526097 0.84 NOTUM (0.49) NOTUMMAPTMEN1KMT2AL3MBTL1
SCHEMBL5860023 0.81 MEN1 (0.68) NOTUMMAPTMEN1KMT2AL3MBTL1
SCHEMBL31427175 0.80 MEN1 (1.00) NOTUMMAPTMEN1KMT2AL3MBTL1
SCHEMBL7824829 0.80 MEN1 (1.00) NOTUMMAPTMEN1KMT2AL3MBTL1
Hydrochloric Acid SCHEMBL19150407 0.80 MEN1 (0.67) NOTUMMAPTMEN1KMT2AL3MBTL1
SCHEMBL28003949 0.78 MEN1 (0.79) MAPTMEN1KMT2AL3MBTL1KDM4E
SCHEMBL525875 0.78 MAPT (0.46) NOTUMMAPTMEN1KMT2AL3MBTL1
SCHEMBL11061527 0.77 KMT2A (0.49) NOTUMMEN1KMT2AL3MBTL1KDM4E

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-2012014186-A1 PROCESS FOR THE PREPARATION OF SILODOSIN AND ITS NOVEL INTERMEDIATES RANBAXY LABORATORIES LIMITED (IN) 2012-02-02 WO disclosed