SCHEMBL6167923

SCHEMBL6167923

CCCc1nc2ccc(C(=O)NCc3ccccn3)cc2n1C(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.53
PDE2A O00408 2/20 0.51
KDM4E B2RXH2 4/20 0.50
HPGD P15428 3/20 0.50
HSD17B10 Q99714 2/20 0.50
PIK3CA P42336 1/20 0.50
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
POLB P06746 3/20 0.48
ALDH1A1 P00352 3/20 0.48
MAPT P10636 2/20 0.48
THRB P10828 1/20 0.48
PKM P14618 1/20 0.48
ALOX15 P16050 1/20 0.48
NR4A1 P22736 1/20 0.48
APEX1 P27695 1/20 0.48
CASP1 P29466 1/20 0.48
PTPN7 P35236 1/20 0.48
RECQL P46063 1/20 0.48
BLM P54132 1/20 0.48

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
SCHEMBL6168527 0.88 NAMPT (0.54) NAMPTPDE2AKDM4EHPGDHSD17B10
SCHEMBL6169466 0.85 KDM4E (0.54) NAMPTPDE2AKDM4EHPGDHSD17B10
SCHEMBL6168396 0.84 AGTR1 (0.54) NAMPTPDE2AKDM4EPIK3CAPOLB
SCHEMBL6169365 0.82 MAPT (0.54) NAMPTPDE2AKDM4EPIK3CAALDH1A1
SCHEMBL7674177 0.81 PDE2A (0.55) NAMPTPDE2AKDM4EHPGDHSD17B10
SCHEMBL6171257 0.80 MAPT (0.58) NAMPTPDE2AKDM4EPIK3CAALDH1A1
SCHEMBL7594143 0.80 PPARG (0.51) PDE2AKDM4EPIK3CAALDH1A1MAPT
SCHEMBL6170879 0.77 NAMPT (0.56) NAMPTPDE2AKDM4EHPGDHSD17B10
SCHEMBL6169026 0.76 AGTR1 (0.51) HPGDMEN1KMT2ARAB9ANPC1
SCHEMBL6171102 0.76 AGTR1 (0.54) NAMPTPDE2AKDM4EHPGDHSD17B10

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 NAMPT 123/4885PDE2A 3774/4885KDM4E 2132/4885

“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.