SCHEMBL6170337

SCHEMBL6170337

CCOC(=O)c1ccc2nc(COC)n(Cc3ccc(OCc4ccccc4)cc3)c2c1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.55
NPC1 O15118 1/20 0.55
NLRP3 Q96P20 1/20 0.55
NPSR1 Q6W5P4 2/20 0.53
CNR1 P21554 1/20 0.49
CNR2 P34972 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
HSP90AA1 P07900 1/20 0.48
TP53 P04637 3/20 0.47
PDE2A O00408 1/20 0.46
LMNA P02545 1/20 0.46
TSHR P16473 1/20 0.46
RAB9A P51151 1/20 0.46
ALOX5AP P20292 3/20 0.46
MAOB P27338 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL6168952 0.90 GLP1R (0.51) MAPTNPSR1CNR1CNR2MEN1
SCHEMBL6173743 0.89 PDE2A (0.54) MAPTNPC1NPSR1MEN1KMT2A
SCHEMBL6172705 0.89 MEN1 (0.52) MAPTNPC1NLRP3NPSR1CNR1
SCHEMBL6168901 0.84 MAPT (0.51) MAPTNPC1NLRP3NPSR1RAB9A
SCHEMBL6170372 0.82 MAPT (0.50) MAPTNPC1NLRP3NPSR1PDE2A
SCHEMBL6170958 0.81 AGTR1 (0.62) MEN1KMT2APDE2ASMN1; SMN2
SCHEMBL1159998 0.81 PPARG (0.48) MAPTCNR1CNR2TP53
SCHEMBL6170729 0.80 PPARG (0.54) NPC1PDE2ARAB9A
SCHEMBL6169424 0.79 TNF (0.56) MAPTNPC1PDE2ALMNATSHR
SCHEMBL6167846 0.79 NR4A2 (0.52) NPC1RAB9AMAOBSMN1; SMN2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882718-B1 BENZIMIDAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2005-08-31 EP disclosed
US-20020082280-A1 Method of inhibiting neoplastic cells with benzimidazole derivatives OSI PHARMACEUTICALS, INC. 2002-06-27 US disclosed
US-6352985-B1 CARDIOVASCULAR DISORDERS OR GASTROINTESTINAL DISORDERS, DIABETES (TYPE II DIABETES), DIABETIC COMPLICATIONS METHOD FOR LOWERING THE BLOOD SUGAR LEVEL OF A PATIENT, FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-05 US disclosed
US-6348032-B1 POTENT COMPOUNDS THAT INDUCE APOPTOSIS IN NEOPLASTIC CELLS (BUT NOT SUBSTANTIALLY IN NORMAL CELLS), WITHOUT SUBSTANTIALLY INHIBITING PGE-2. CELL PATHWAYS, INC. 2002-02-19 US disclosed
US-6166219-A Benzimidazole derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-12-26 US disclosed
EP-0882718-A1 BENZIMIDAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-12-09 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020082280-A1 Method of inhibiting neoplastic cells with benzimidazole derivatives MKI67, CCNI, TMBIM6 MAPT 4390/4885NPC1 827/4885NLRP3 4304/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.