SCHEMBL7978174

SCHEMBL7978174

O=C(Nc1nccs1)c1nc(-c2ccc([N+](=O)[O-])cc2)[nH]c1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.56
LMNA P02545 5/20 0.56
NPC1 O15118 4/20 0.56
KDM4E B2RXH2 3/20 0.56
RAB9A P51151 4/20 0.53
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
GAA P10253 3/20 0.53
TDP1 Q9NUW8 3/20 0.53
POLB P06746 2/20 0.53
MGAM O43451 2/20 0.53
ALDH1A1 P00352 2/20 0.53
SI P14410 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
MGAM2 Q2M2H8 2/20 0.53
STAT1 P42224 1/20 0.53
RECQL P46063 1/20 0.53
MAPK1 P28482 2/20 0.50
TSHR P16473 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.49

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
Hydrochloric Acid SCHEMBL7977594 0.99 MAPT (0.55) MAPTLMNANPC1KDM4ERAB9A
SCHEMBL7978116 0.96 LMNA (0.61) MAPTLMNANPC1KDM4ERAB9A
SCHEMBL7991811 0.92 LMNA (0.56) MAPTLMNANPC1KDM4ERAB9A
SCHEMBL7988571 0.91 MAPT (0.55) MAPTLMNANPC1KDM4ERAB9A
SCHEMBL7991856 0.91 LMNA (0.55) MAPTLMNANPC1KDM4ERAB9A
Hydrochloric Acid SCHEMBL7992009 0.91 LMNA (0.55) MAPTLMNANPC1KDM4ERAB9A
SCHEMBL7991955 0.91 MAPT (0.55) MAPTLMNANPC1KDM4ERAB9A
SCHEMBL7988989 0.90 MEN1 (0.56) MAPTLMNANPC1KDM4ERAB9A
SCHEMBL7991798 0.89 MAPT (0.53) MAPTLMNANPC1KDM4ERAB9A
SCHEMBL7988913 0.89 MAPT (0.54) MAPTLMNANPC1KDM4ERAB9A

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