SCHEMBL10458697

SCHEMBL10458697

CC(=NO)c1ccc(NC(=O)NCC(=O)Oc2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.44
ALDH1A1 P00352 2/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC2 Q92769 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
F7 P08709 3/20 0.42
F2 P00734 2/20 0.42
NAMPT P43490 1/20 0.42
MEN1 O00255 1/20 0.42
THRB P10828 1/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 1/20 0.42
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41

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
SCHEMBL10458695 1.00 MAPT (0.44) MAPTALDH1A1HDAC1HDAC2SMN1; SMN2
SCHEMBL10458283 0.84 CA12 (0.57) MAPTALDH1A1HDAC1HDAC2SMN1; SMN2
SCHEMBL10458284 0.84 CA12 (0.57) MAPTALDH1A1HDAC1HDAC2SMN1; SMN2
SCHEMBL21753692 0.83 EPHX1 (0.52) ALDH1A1SMN1; SMN2RAB9ANPC1MEN1
SCHEMBL10458331 0.82 SMN1; SMN2 (0.40) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL10458464 0.82 POLB (0.50) MAPTHDAC1HDAC2SMN1; SMN2RAB9A
SCHEMBL10458705 0.81 CA12 (0.44) MAPTALDH1A1HDAC1HDAC2SMN1; SMN2
SCHEMBL10458690 0.81 PPID (0.56) MAPTALDH1A1HDAC1HDAC2SMN1; SMN2
SCHEMBL10458688 0.81 PPID (0.56) MAPTALDH1A1HDAC1HDAC2SMN1; SMN2
SCHEMBL10456796 0.81 CA12 (0.44) MAPTALDH1A1HDAC1HDAC2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4977272-A Radiation absorbers THE STANDARD OIL COMPANY (US) 1990-12-11 US disclosed
US-4740611-A N,N'-disubstituted ureas THE STANDARD OIL COMPANY (US) 1988-04-26 US disclosed