SCHEMBL5854260

SCHEMBL5854260

CS(=O)(=O)c1ccc(-c2ncnc3ccc(-c4c[nH]nc4[N+](=O)[O-])cc23)s1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KIT P10721 1/20 0.30
CD38 P28907 1/20 0.30

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 SCHEMBL3856201 0.85 CA12 (0.33) KITCD38
SCHEMBL3854332 0.83 KIT (0.35) KITCD38
SCHEMBL4715276 0.82 KIT (0.38) KIT
SCHEMBL3852540 0.81 STK17B (0.33) KITCD38
Hydrochloric Acid SCHEMBL3848084 0.81 CYP1A2 (0.33) KITCD38
Hydrochloric Acid SCHEMBL3854735 0.81 KIT (0.38) KIT
Hydrochloric Acid SCHEMBL3846886 0.81 MAP4K4 (0.34) KITCD38
Hydrochloric Acid SCHEMBL3851460 0.81 MAP4K4 (0.38) KIT
SCHEMBL3848264 0.81 CYP1A2 (0.39)
SCHEMBL3848218 0.81 KIT (0.36) KITCD38

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-7074801-B1 Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof EISAI CO., LTD. (JP) 2006-07-11 US disclosed