SCHEMBL7991665

SCHEMBL7991665

Nc1ccc(-c2nc(C(=O)Nc3nccs3)c(-c3ccccc3)[nH]2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.53
MAPK1 P28482 2/20 0.53
POLB P06746 1/20 0.53
TSHR P16473 1/20 0.53
NPC1 O15118 4/20 0.53
LMNA P02545 4/20 0.53
L3MBTL1 Q9Y468 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
RECQL P46063 1/20 0.53
MAPK8 P45983 1/20 0.48
GAA P10253 2/20 0.48
ALDH1A1 P00352 1/20 0.48
KDM4E B2RXH2 2/20 0.47
ESR1 P03372 1/20 0.47
MAPT P10636 2/20 0.47
MEN1 O00255 1/20 0.47
GLA P06280 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
SIRT2 Q8IXJ6 1/20 0.47

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
SCHEMBL7991587 0.96 RAB9A (0.57) RAB9AMAPK1POLBTSHRNPC1
SCHEMBL7977923 0.91 MEN1 (0.52) RAB9AMAPK1POLBTSHRNPC1
SCHEMBL7991953 0.91 RAB9A (0.52) RAB9AMAPK1POLBTSHRNPC1
SCHEMBL7977950 0.91 MAPT (0.53) RAB9AMAPK1POLBTSHRNPC1
Hydrochloric Acid SCHEMBL7991746 0.88 RAB9A (0.54) RAB9AMAPK1POLBTSHRNPC1
SCHEMBL7994909 0.88 RAB9A (0.52) RAB9AMAPK1POLBTSHRNPC1
SCHEMBL7977759 0.88 MEN1 (0.57) RAB9AMAPK1TSHRNPC1LMNA
SCHEMBL7977619 0.88 RAB9A (0.52) RAB9AMAPK1POLBTSHRNPC1
Hydrochloric Acid SCHEMBL7988505 0.87 RAB9A (0.51) RAB9AMAPK1POLBTSHRNPC1
SCHEMBL7991866 0.87 MAPK1 (0.51) RAB9AMAPK1POLBTSHRNPC1

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