SCHEMBL19554339

SCHEMBL19554339

N/C(=N\O)c1cc(Cl)ccc1N

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.57
KMT2A Q03164 2/20 0.57
GFER P55789 1/20 0.57
NOS2 P35228 2/20 0.50
RECQL P46063 1/20 0.47
CYP3A4 P08684 3/20 0.46
ALOX15 P16050 3/20 0.46
TSHR P16473 3/20 0.46
ALDH1A1 P00352 3/20 0.46
TDP1 Q9NUW8 1/20 0.46
USP2 O75604 1/20 0.44
LMNA P02545 1/20 0.44
MEN1 O00255 1/20 0.44
FADS1 O60427 1/20 0.42
HPGD P15428 1/20 0.42
ALOX12 P18054 1/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ABL1 P00519 1/20 0.41
KDM4E B2RXH2 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
SCHEMBL8964399 1.00 SMN1; SMN2 (0.57) SMN1; SMN2KMT2AGFERNOS2RECQL
SCHEMBL4947860 0.84 ALOX15 (0.49) SMN1; SMN2KMT2AGFERCYP3A4ALOX15
SCHEMBL17738062 0.82 LMNA (0.47) SMN1; SMN2KMT2AGFERCYP3A4ALOX15
SCHEMBL103642 0.82 LMNA (0.47) SMN1; SMN2KMT2AGFERCYP3A4ALOX15
SCHEMBL103641 0.82 LMNA (0.47) SMN1; SMN2KMT2AGFERCYP3A4ALOX15
SCHEMBL102768 0.82 ALDH1A1 (0.50) SMN1; SMN2KMT2AGFERRECQLCYP3A4
SCHEMBL102769 0.82 ALDH1A1 (0.50) SMN1; SMN2KMT2AGFERRECQLCYP3A4
SCHEMBL17737719 0.80 USP2 (0.44) SMN1; SMN2KMT2AGFERALOX15ALDH1A1
SCHEMBL17730420 0.80 USP2 (0.44) SMN1; SMN2KMT2AGFERALOX15ALDH1A1
SCHEMBL17730419 0.80 USP2 (0.44) SMN1; SMN2KMT2AGFERALOX15ALDH1A1

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-2017192304-A1 ARYLCARBOXAMIDES AND USES THEREOF INCEPTION 1, INC. (US) 2017-11-09 WO disclosed