SCHEMBL8938136

SCHEMBL8938136

CCOC(NCc1ccccc1)(C(N)=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
PPID Q08752 1/20 0.43
LMNA P02545 2/20 0.41
MAPK1 P28482 1/20 0.40
KMT2A Q03164 2/20 0.40
MAPT P10636 2/20 0.40
POLB P06746 1/20 0.40
THRB P10828 1/20 0.40
RIPK1 Q13546 1/20 0.40
MEN1 O00255 1/20 0.40
RAB9A P51151 2/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
KIF11 P52732 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
SCHEMBL9257281 0.80 BCAT2 (0.49) SMN1; SMN2LMNAMAPTPOLBRAB9A
SCHEMBL8083083 0.78 MAOB (0.47) POLBRAB9A
SCHEMBL9362874 0.76 CYP2D6 (0.56) LMNAMAPTKDM4EALDH1A1
SCHEMBL7763138 0.74 KMT2A (0.50) SMN1; SMN2LMNAMAPK1KMT2AMAPT
SCHEMBL5682138 0.73 ALDH1A1 (0.47) SMN1; SMN2RAB9AALDH1A1NPC1HPGD
SCHEMBL8938148 0.73 BCAT2 (0.39) POLBKIF11
SCHEMBL5509050 0.73 MAPT (0.44) SMN1; SMN2MAPK1KMT2AMAPTALDH1A1
SCHEMBL27339130 0.72 KMT2A (0.41) SMN1; SMN2PPIDLMNAMAPK1KMT2A
SCHEMBL9262043 0.72 PNMT (0.48) SMN1; SMN2KMT2APOLBMEN1ALDH1A1
SCHEMBL2850028 0.72 RIPK1 (0.49) SMN1; SMN2LMNAKMT2AMAPTTHRB

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
US-5502078-A Chemical compounds ZENECA LIMITED (GB) 1996-03-26 US disclosed