SCHEMBL9454814

SCHEMBL9454814

OCc1ccnc(-c2cnco2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RECQL P46063 1/20 0.43
▸ PTK2 Q05397 1/20 0.41
▸ CYP4F2 P78329 2/20 0.38
▸ CYP4A11 Q02928 2/20 0.38
▸ ROCK2 O75116 1/20 0.37
▸ KRAS P01116 2/20 0.36
▸ LOXL2 Q9Y4K0 1/20 0.36
▸ NOTUM Q6P988 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ CYP11B1 P15538 1/20 0.35
▸ CYP11B2 P19099 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ MAP4K4 O95819 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ PLAU P00749 1/20 0.33
▸ PRKCI P41743 1/20 0.33

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
SCHEMBL25202974 0.84 LOXL2 (0.53) PTK2CYP4F2CYP4A11ROCK2LOXL2
Hydrochloric Acid SCHEMBL25233438 0.83 LOXL2 (0.51) PTK2CYP4F2CYP4A11ROCK2LOXL2
SCHEMBL25880732 0.78 RECQL (0.46) RECQLCYP4F2CYP4A11ROCK2LOXL2
SCHEMBL26971050 0.77 CYP4F2 (0.45) PTK2CYP4F2CYP4A11ROCK2NOTUM
SCHEMBL29393772 0.76 RECQL (0.61) RECQLKRASLOXL2PLAUPRKCI
SCHEMBL1411265 0.76 RECQL (0.61) RECQLKRASLOXL2PLAUPRKCI
SCHEMBL28500936 0.75 MEN1 (0.53) PTK2CYP4F2CYP4A11ROCK2NOTUM
SCHEMBL25255179 0.72 NAMPT (0.43) CYP4F2CYP4A11CYP3A4
SCHEMBL3207637 0.72 MEN1 (0.58) PTK2NOTUMGAALMNAPKM
SCHEMBL2429842 0.70 PKM (0.58) PTK2NOTUMGAALMNAPKM

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-5234946-A Anticholesterol, antilipemic BANYU PHARMACEUTICAL CO., LTD. (JP) 1993-08-10 — — US disclosed
Send feedback