SCHEMBL7991849

SCHEMBL7991849

CNc1cccc(-c2nc(C(=O)Nc3nccs3)c(-c3cccc(OC)c3)[nH]2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
MAPT P10636 4/20 0.48
HPGD P15428 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
ALDH1A1 P00352 2/20 0.48
HTT P42858 2/20 0.48
USP2 O75604 1/20 0.48
LMNA P02545 1/20 0.48
TAAR1 Q96RJ0 1/20 0.48
HSD17B10 Q99714 1/20 0.48
RAB9A P51151 4/20 0.47
NPC1 O15118 3/20 0.47
MAPK1 P28482 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
GCK P35557 1/20 0.45
PIN1 Q13526 1/20 0.45
HPGDS O60760 1/20 0.44
GAA P10253 2/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL7977760 0.93 MAPK1 (0.51) MEN1KMT2AMAPTHPGDSMN1; SMN2
SCHEMBL7995546 0.93 MAPK1 (0.55) MEN1KMT2AMAPTHPGDSMN1; SMN2
SCHEMBL7989469 0.89 MEN1 (0.49) MEN1KMT2AMAPTHPGDSMN1; SMN2
SCHEMBL7989961 0.88 MAPK1 (0.45) MEN1KMT2AMAPTHPGDSMN1; SMN2
SCHEMBL7988543 0.88 KMT2A (0.48) MEN1KMT2AMAPTHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL7988593 0.88 MAPK1 (0.50) MEN1KMT2AMAPTHPGDSMN1; SMN2
SCHEMBL7992383 0.87 L3MBTL1 (0.51) MEN1KMT2AMAPTHPGDSMN1; SMN2
SCHEMBL7995211 0.86 SMN1; SMN2 (0.50) MEN1KMT2AMAPTHPGDSMN1; SMN2
SCHEMBL7991873 0.86 RAB9A (0.45) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL7995895 0.86 MEN1 (0.47) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1

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-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US disclosed