SCHEMBL25783467

SCHEMBL25783467

c1ccc(-c2cc3c([nH]c4ccccc43)c(OCCn3cccn3)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.38
▸ PRKAB2 O43741 1/20 0.38
▸ PRKAG1 P54619 1/20 0.38
▸ PRKAA2 P54646 1/20 0.38
▸ PRKAA1 Q13131 1/20 0.38
▸ PRKAG3 Q9UGI9 1/20 0.38
▸ PRKAG2 Q9UGJ0 1/20 0.38
▸ PRKAB1 Q9Y478 1/20 0.38
▸ HTR2B P41595 2/20 0.38
▸ HTR5A P47898 2/20 0.38
▸ TDO2 P48775 1/20 0.38
▸ NQO2 P16083 1/20 0.37
▸ IDO1 P14902 1/20 0.37
▸ KDM4E B2RXH2 4/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ HPGD P15428 2/20 0.36
▸ HTT P42858 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36

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
SCHEMBL23875533 0.84 SMN1; SMN2 (0.47) MAPK1KDM4EALDH1A1HPGDHTT
SCHEMBL25783763 0.83 TBXAS1 (0.48) MAPK1KDM4EALDH1A1LMNAHSD17B10
SCHEMBL25783627 0.75 IDO1 (0.43) MAPK1PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL25783465 0.75 IDO1 (0.43) MAPK1PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL25788656 0.71 MEN1 (0.36) MAPK1HTR2BHTR5ATDO2NQO2
SCHEMBL25784580 0.70 KDM4E (0.41) HTR2BHTR5ATDO2NQO2KDM4E
SCHEMBL25783488 0.68 KDM4E (0.38) HTR2BHTR5ATDO2NQO2KDM4E
Ammonia Solution, Strong SCHEMBL28650410 0.67 HTR2B (0.58) HTR2BHTR5ATDO2NQO2MEN1
SCHEMBL25783407 0.66 NLRP3 (0.39) HTR2BHTR5ATDO2KDM4EALDH1A1
SCHEMBL25783758 0.65 SMN1; SMN2 (0.55) MAPK1KDM4EALDH1A1HTTSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230174485-A1 LIPOXYGENASE INHIBITORS SRI INTERNATIONAL (US) 2023-06-08 — — 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-20230174485-A1 LIPOXYGENASE INHIBITORS ALOX15B, ALOX12, ALOX15 MAPK1 1479/4885PRKAB2 2388/4885PRKAG1 2928/4885

“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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