SCHEMBL7746650

SCHEMBL7746650

COc1ccccc1N(Cc1ccccc1)C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.49
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 2/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
ACHE P22303 3/20 0.46
BCHE P06276 2/20 0.46
TRPM8 Q7Z2W7 1/20 0.46
POLB P06746 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
LMNA P02545 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.43
HSD17B1 P14061 1/20 0.42
HSD17B2 P37059 1/20 0.42
RXRA P19793 1/20 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
SCHEMBL7746646 0.85 SMN1; SMN2 (0.49) SMN1; SMN2MEN1KMT2AALDH1A1ALOX15
SCHEMBL4286533 0.83 ESR1 (0.48) SMN1; SMN2MEN1KMT2AALDH1A1TSHR
SCHEMBL1334670 0.81 POLB (0.50) SMN1; SMN2MEN1KMT2AALDH1A1ALOX15
SCHEMBL7566732 0.78 TSPO (0.61)
SCHEMBL10941845 0.78 ESR1 (0.49) SMN1; SMN2MEN1KMT2AALDH1A1TSHR
SCHEMBL6778747 0.76 NPC1 (0.55) SMN1; SMN2MEN1KMT2AALDH1A1TSHR
SCHEMBL27477279 0.75 KMT2A (0.41) SMN1; SMN2MEN1KMT2AALDH1A1HTT
SCHEMBL12368118 0.75 TSHR (0.50) SMN1; SMN2MEN1KMT2AALDH1A1TSHR
SCHEMBL3043454 0.75 ALDH1A1 (0.47) SMN1; SMN2MEN1KMT2AALDH1A1ALOX15
SCHEMBL11381825 0.75 CA1 (0.50) SMN1; SMN2KMT2AALDH1A1TSHRHTT

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-2001010798-A1 SOLID PHASE SYNTHESIS OF OXA- AND THIAZOLES CHEMRX ADVANCED TECHNOLOGIES, INC. (US) 2001-02-15 WO disclosed