SCHEMBL6169026

SCHEMBL6169026

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

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 7/20 0.51
AGTR2 P50052 7/20 0.51
PPARG P37231 3/20 0.48
ACSS2 Q9NR19 1/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
HCAR3 P49019 3/20 0.44
HPGD P15428 1/20 0.44
HCAR2 Q8TDS4 1/20 0.44
HDAC6 Q9UBN7 1/20 0.43
PTGER4 P35408 1/20 0.43

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
SCHEMBL3643686 0.83 AGTR1 (0.53) AGTR1AGTR2PPARGACSS2MEN1
SCHEMBL6168981 0.79 AGTR1 (0.57) AGTR1AGTR2PPARGACSS2HCAR3
SCHEMBL6168561 0.77 AGTR1 (0.76) AGTR1AGTR2PPARG
SCHEMBL29016546 0.76 RORC (0.52) PPARGACSS2
SCHEMBL30369842 0.76 RORC (0.52) PPARGACSS2
SCHEMBL6167923 0.76 NAMPT (0.53) MEN1NPC1RAB9AKMT2AHPGD
SCHEMBL6168957 0.75 AGTR1 (0.69) AGTR1AGTR2PPARGNPC1RAB9A
SCHEMBL8906502 0.75 HCAR3 (0.53) AGTR1AGTR2MEN1KMT2AHCAR3
SCHEMBL8556792 0.74 ACSS2 (0.48) AGTR1AGTR2PPARGACSS2MEN1
SCHEMBL4235247 0.73 MEN1 (0.53) MEN1NPC1RAB9AKMT2AHDAC6

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 AGTR1 4001/4885AGTR2 3926/4885PPARG 1181/4885

“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.