SCHEMBL25783474

SCHEMBL25783474

c1ccc(-c2cc3c(cc2NCCn2cccn2)[nH]c2ccccc23)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NLRP3 Q96P20 1/20 0.39
▸ MMP2 P08253 1/20 0.37
▸ MMP9 P14780 1/20 0.37
▸ MMP8 P22894 1/20 0.37
▸ MMP13 P45452 1/20 0.37
▸ PDE3B Q13370 1/20 0.36
▸ PDE3A Q14432 1/20 0.36
▸ AHR P35869 1/20 0.36
▸ HDAC1 Q13547 1/20 0.36
▸ KDM4E B2RXH2 5/20 0.35
▸ PRKAB2 O43741 1/20 0.35
▸ PRKAG1 P54619 1/20 0.35
▸ PRKAA2 P54646 1/20 0.35
▸ PRKAA1 Q13131 1/20 0.35
▸ PRKAG3 Q9UGI9 1/20 0.35
▸ PRKAG2 Q9UGJ0 1/20 0.35
▸ PRKAB1 Q9Y478 1/20 0.35
▸ UTS2R Q9UKP6 2/20 0.34
▸ HPGD P15428 1/20 0.34
▸ MAPK1 P28482 1/20 0.34

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
SCHEMBL23875556 0.84 SMN1; SMN2 (0.41) MMP2MMP9MMP8MMP13AHR
SCHEMBL25783407 0.78 NLRP3 (0.39) NLRP3MMP2MMP9MMP8MMP13
SCHEMBL25783488 0.74 KDM4E (0.38) MMP2MMP9MMP8MMP13KDM4E
SCHEMBL23609193 0.73 NLRP3 (0.40) NLRP3PDE3BPDE3AHDAC1
SCHEMBL25783416 0.72 HDAC1 (0.38) NLRP3PDE3BPDE3AHDAC1KDM4E
SCHEMBL25783495 0.72 GAA (0.36) NLRP3HDAC1KDM4EHPGDHTT
SCHEMBL23875558 0.70 TDO2 (0.47) KDM4EHPGDMAPK1HTTSMN1; SMN2
SCHEMBL25783490 0.70 FGFR1 (0.38) AHRKDM4EALDH1A1NPSR1L3MBTL1
SCHEMBL25784580 0.70 KDM4E (0.41) KDM4EALDH1A1NPSR1L3MBTL1
SCHEMBL17196634 0.69 MMP2 (0.52) MMP2MMP9MMP8MMP13AHR

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 NLRP3 2175/4885MMP2 533/4885MMP9 828/4885

“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.

Send feedback