SCHEMBL3000254

SCHEMBL3000254

C/C(=N\Nc1nc2ccccc2s1)c1cccc(-c2ccc(C(=O)O)o2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 9/20 0.61
▸ KMT2A Q03164 9/20 0.61
▸ RAB9A P51151 6/20 0.61
▸ MAPT P10636 6/20 0.61
▸ SMN1; SMN2 Q16637 4/20 0.61
▸ GAA P10253 4/20 0.61
▸ MAPK1 P28482 1/20 0.61
▸ BCL2L1 Q07817 2/20 0.58
▸ LMNA P02545 4/20 0.53
▸ HTT P42858 1/20 0.53
▸ NPC1 O15118 4/20 0.50
▸ KDM4E B2RXH2 2/20 0.50
▸ ATM Q13315 1/20 0.50
▸ HSP90AA1 P07900 3/20 0.48
▸ HPGD P15428 2/20 0.47
▸ ALOX12 P18054 2/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.46
▸ ALDH1A1 P00352 3/20 0.44
▸ MAOA P21397 1/20 0.43
▸ MAOB P27338 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
SCHEMBL3000257 1.00 MEN1 (0.61) MEN1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL13209142 0.86 MEN1 (0.70) MEN1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL3017673 0.86 MEN1 (0.70) MEN1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL3010309 0.83 BCL2L1 (0.65) MEN1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL3010305 0.83 BCL2L1 (0.65) MEN1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL3001736 0.82 MEN1 (0.65) MEN1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL3001733 0.82 MEN1 (0.65) MEN1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL13881935 0.81 BCL2L1 (0.60) MEN1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL3012824 0.81 BCL2L1 (0.52) MEN1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL3012828 0.81 BCL2L1 (0.52) MEN1KMT2ARAB9AMAPTSMN1; 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-20100197711-A1 BENZOTHIAZOLE COMPOUNDS THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2010-08-05 — — US disclosed
EP-2193127-A1 BENZOTHIAZOLE COMPOUNDS The Walter and Eliza Hall Institute of Medical Research (AU) 2010-06-09 — — EP disclosed
WO-2009039553-A1 BENZOTHIAZOLE COMPOUNDS THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2009-04-02 — — WO 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-20100197711-A1 BENZOTHIAZOLE COMPOUNDS BAD, BCL2, BAX MEN1 3073/4885KMT2A 2439/4885RAB9A 3879/4885

“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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