SCHEMBL29946136

SCHEMBL29946136

O=C(O)c1cccc(-n2cc(-c3ccc(-c4ccccc4)cc3)nn2)c1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.69
NFE2L2 Q16236 1/20 0.69
STIM1 Q13586 9/20 0.65
ORAI1 Q96D31 9/20 0.65
LDHA P00338 2/20 0.60
MAOA P21397 1/20 0.59
MAOB P27338 1/20 0.59
HSD17B1 P14061 1/20 0.57
HSD17B2 P37059 1/20 0.57
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA4 P22748 1/20 0.56
CA7 P43166 1/20 0.56
CA9 Q16790 1/20 0.56
P2RY14 Q15391 4/20 0.56
OGT O15294 1/20 0.55

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
SCHEMBL26628305 1.00 KEAP1 (0.69) KEAP1NFE2L2STIM1ORAI1LDHA
SCHEMBL29946192 0.90 STIM1 (0.76) KEAP1NFE2L2STIM1ORAI1LDHA
SCHEMBL26628304 0.90 STIM1 (0.76) KEAP1NFE2L2STIM1ORAI1LDHA
SCHEMBL1429925 0.90 STIM1 (0.64) KEAP1NFE2L2STIM1ORAI1LDHA
SCHEMBL1427395 0.90 STIM1 (0.66) KEAP1NFE2L2STIM1ORAI1LDHA
SCHEMBL1430338 0.90 STIM1 (0.63) KEAP1NFE2L2STIM1ORAI1LDHA
SCHEMBL2711661 0.90 STIM1 (0.67) KEAP1NFE2L2STIM1ORAI1LDHA
SCHEMBL29946256 0.90 STIM1 (0.63) KEAP1NFE2L2STIM1ORAI1LDHA
SCHEMBL29946185 0.87 STIM1 (0.86) KEAP1NFE2L2STIM1ORAI1LDHA
SCHEMBL29946274 0.87 STIM1 (0.60) KEAP1NFE2L2STIM1ORAI1LDHA

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
EP-4106871-A1 BIPHENYL COMPOUNDS AS SOCE MODULATORS, COMPOSITIONS AND USES THEREOF Università degli Studi del Piemonte Orientale "Amedeo Avogadro" (IT) 2022-12-28 EP claimed
CN-115243765-A Biphenyl compounds as SOCE modulators, compositions and uses thereof 皮埃蒙特阿米阿伏伽德罗东方大学 2022-10-25 CN claimed
US-20230348404-A1 BIPHENYL COMPOUNDS AS SOCE MODULATORS, COMPOSITIONS AND USES THEREOF UNIVERSITÀ DEGLI STUDI DEL PIEMONTE ORIENTALE "AMEDEO AVOGADRO" (IT) 2023-11-02 US 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-20230348404-A1 BIPHENYL COMPOUNDS AS SOCE MODULATORS, COMPOSITIONS AND USES THEREOF ORAI1, SARAF, STIM1 KEAP1 1857/4885NFE2L2 525/4885STIM1 3/4885

“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.