SCHEMBL7992647

SCHEMBL7992647

Cc1cc2cnncc2cn1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.56
CYP2A6 P11509 1/20 0.56
ALDH1A1 P00352 1/20 0.42
UHRF1 Q96T88 2/20 0.41
CCR1 P32246 1/20 0.36
CCR5 P51681 1/20 0.36
CCR8 P51685 1/20 0.36
IL5 P05113 1/20 0.32
ABL1 P00519 1/20 0.30

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
SCHEMBL18266963 0.89 CYP1A2 (0.67) CYP1A2CYP2A6ALDH1A1UHRF1CCR1
SCHEMBL18266965 0.86 CYP1A2 (0.64) CYP1A2CYP2A6ALDH1A1UHRF1CCR1
SCHEMBL17090673 0.83 CYP1A2 (0.61) CYP1A2CYP2A6ALDH1A1UHRF1CCR1
SCHEMBL14970138 0.79 CYP1A2 (0.56) CYP1A2CYP2A6ALDH1A1UHRF1CCR1
SCHEMBL17553029 0.75 CYP1A2 (0.52) CYP1A2CYP2A6ALDH1A1UHRF1CCR1
SCHEMBL15632245 0.75 CYP1A2 (0.52) CYP1A2CYP2A6ALDH1A1UHRF1CCR1
SCHEMBL31220021 0.75 CYP1A2 (0.52) CYP1A2CYP2A6ALDH1A1UHRF1CCR1
SCHEMBL6844960 0.75 CYP1A2 (0.52) CYP1A2CYP2A6ALDH1A1UHRF1CCR1
SCHEMBL8167276 0.75 CYP1A2 (0.52) CYP1A2CYP2A6UHRF1CCR1CCR5
SCHEMBL8166969 0.75 CYP1A2 (0.52) CYP1A2CYP2A6UHRF1CCR1CCR5

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023110138-A1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2023-06-22 WO disclosed
WO-2023275337-A1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2023-01-05 WO disclosed
WO-2023275336-A1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2023-01-05 WO disclosed
WO-2023275333-A1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2023-01-05 WO disclosed
EP-2307400-B1 INHIBITORS OF PI3 KINASE AMGEN INC (US) 2014-04-23 EP disclosed
US-8415376-B2 Inhibitors of PI3 kinase AMGEN INC. (US) 2013-04-09 US disclosed
WO-2013007663-A1 2-BENZYLSULFANYL[1,3,4]-OXADIAZOLE DERIVATIVES, AND MEDICAL USE THEREOF Technische Universität Darmstadt (DE) 2013-01-17 WO disclosed
US-20110092504-A1 INHIBITORS OF PI3 KINASE AMGEN INC. 2011-04-21 US disclosed
WO-2009155121-A2 INHIBITORS OF PI3 KINASE AMGEN INC. (US) 2009-12-23 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-20110092504-A1 INHIBITORS OF PI3 KINASE PIK3CA, PIK3R1, PIK3R5 CYP1A2 3274/4885CYP2A6 3568/4885ALDH1A1 3672/4885

“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.