SCHEMBL6313989

SCHEMBL6313989

O=C(O)C(=O)Nc1c[c]ccc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GPR35 Q9HC97 4/20 0.57
▸ PTPN11 Q06124 3/20 0.48
▸ PTPN1 P18031 1/20 0.48
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ CYP19A1 P11511 2/20 0.40
▸ TP53 P04637 1/20 0.39
▸ EPHX1 P07099 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ EPHX2 P34913 1/20 0.39
▸ CDK9 P50750 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CLK4 Q9HAZ1 1/20 0.39

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
SCHEMBL2531539 0.84 EPHX2 (0.41) GPR35PTPN1KMT2ATP53EPHX1
SCHEMBL2518709 0.81 SMN1; SMN2 (0.65) MEN1KMT2ATP53EPHX1TSHR
SCHEMBL3911427 0.80 TDP1 (0.54) GPR35KMT2ASMN1; SMN2
SCHEMBL50031 0.78 HSD17B10 (0.57) MEN1KMT2ATSHRSMN1; SMN2
SCHEMBL789578 0.78 GAA (0.50) MEN1KMT2ATP53EPHX1TSHR
SCHEMBL750529 0.78 KCNK3 (0.59) PTPN1MEN1KMT2ATP53SMN1; SMN2
SCHEMBL7515812 0.77 DHODH (0.61) MEN1KMT2ATSHR
SCHEMBL7515816 0.77 DHODH (0.61) MEN1KMT2ATSHR
SCHEMBL616739 0.77 PTPN11 (0.75) GPR35PTPN11PTPN1MEN1KMT2A
SCHEMBL1418819 0.76 SCN1A (0.40) MEN1KMT2AEPHX2SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050014810-A1 Use of substituted 2 phenylbenzimidazoles as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-01-20 — — US disclosed
EP-0028351-B1 REACTIVE DYESTUFFS AND THEIR USE IN DYEING MATERIALS CONTAINING OH OR NH BAYER AG (DE) 1984-02-22 — — EP disclosed
EP-0028351-A2 Reactive dyestuffs and their use in dyeing materials containing OH or NH BAYER AG (DE) 1981-05-13 — — 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-20050014810-A1 Use of substituted 2 phenylbenzimidazoles as medicaments GLP1R, GIPR, GCGR GPR35 240/4885PTPN11 1622/4885PTPN1 1256/4885

“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.

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