SCHEMBL7994926

SCHEMBL7994926

O=C(Nc1nccs1)c1nc(-c2cccc3ccccc23)[nH]c1-c1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.45
MEN1 O00255 7/20 0.45
KMT2A Q03164 7/20 0.45
NPC1 O15118 7/20 0.45
MAPT P10636 5/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
KDM4E B2RXH2 3/20 0.45
MGAM O43451 2/20 0.45
GAA P10253 2/20 0.45
SI P14410 2/20 0.45
MGAM2 Q2M2H8 2/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
ALDH1A1 P00352 3/20 0.45
SIRT2 Q8IXJ6 1/20 0.45
POLB P06746 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
LMNA P02545 3/20 0.44

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
SCHEMBL7977710 0.92 RAB9A (0.52) RAB9AMEN1KMT2ANPC1MAPT
SCHEMBL6707244 0.91 RAB9A (0.48) RAB9AMEN1KMT2ANPC1MAPT
SCHEMBL7991875 0.91 RAB9A (0.47) RAB9AMEN1KMT2ANPC1MAPT
SCHEMBL7991983 0.91 MAPK13 (0.50) RAB9AMEN1KMT2ANPC1MAPT
Hydrochloric Acid SCHEMBL7991518 0.90 MEN1 (0.49) RAB9AMEN1KMT2ANPC1MAPT
Hydrochloric Acid SCHEMBL7989998 0.89 ALDH1A1 (0.42) RAB9AMEN1KMT2ANPC1MAPT
SCHEMBL7977588 0.89 SIRT2 (0.43) RAB9AMEN1KMT2ANPC1MAPT
SCHEMBL7988277 0.88 SIRT2 (0.43) RAB9AMEN1KMT2ANPC1MAPT
SCHEMBL7991541 0.88 RAB9A (0.44) RAB9AMEN1KMT2ANPC1MAPT
SCHEMBL7995180 0.88 MAPK1 (0.53) RAB9AMEN1KMT2ANPC1MAPT

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