SCHEMBL6170935

SCHEMBL6170935

Cc1nc2ccc(C=CC(=O)O)cc2n1Cc1ccccc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
MAPT P10636 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
PPARG P37231 1/20 0.48
HDAC1 Q13547 3/20 0.46
SLC22A12 Q96S37 1/20 0.46
ATM Q13315 1/20 0.46
HDAC8 Q9BY41 2/20 0.46
APP P05067 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
KDM4E B2RXH2 2/20 0.45
HPGD P15428 1/20 0.45
HTT P42858 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TNF P01375 3/20 0.45
NOD2 Q9HC29 1/20 0.43
NOD1 Q9Y239 1/20 0.43
NPC1 O15118 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
SCHEMBL6170933 1.00 ALDH1A1 (0.49) ALDH1A1MAPTSMN1; SMN2PPARGHDAC1
SCHEMBL6168576 0.89 MAPT (0.47) ALDH1A1MAPTSMN1; SMN2PPARGHDAC1
SCHEMBL6168578 0.89 MAPT (0.47) ALDH1A1MAPTSMN1; SMN2PPARGHDAC1
SCHEMBL6169147 0.85 HDAC1 (0.48) ALDH1A1MAPTSMN1; SMN2PPARGHDAC1
SCHEMBL1193702 0.85 HDAC1 (0.48) ALDH1A1MAPTSMN1; SMN2PPARGHDAC1
SCHEMBL6169244 0.85 HDAC1 (0.48) ALDH1A1MAPTSMN1; SMN2PPARGHDAC1
SCHEMBL6170548 0.84 GALR3 (0.48) ALDH1A1MAPTSMN1; SMN2PPARGKDM4E
SCHEMBL6169166 0.81 PPARG (0.57) ALDH1A1MAPTSMN1; SMN2PPARGHDAC1
SCHEMBL6172736 0.79 SLC22A12 (0.58) ALDH1A1MAPTSMN1; SMN2PPARGHDAC1
SCHEMBL7658106 0.78 PPARG (0.51) ALDH1A1MAPTSMN1; SMN2PPARGHDAC1

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 ALDH1A1 487/4885MAPT 4390/4885SMN1; SMN2 4367/4885

“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.