SCHEMBL24074303

SCHEMBL24074303

N#Cc1ccc(-c2nc3cc(F)c(F)cc3[nH]2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RHEB Q15382 1/20 0.69
▸ KDM4E B2RXH2 2/20 0.63
▸ ALDH1A1 P00352 2/20 0.63
▸ CYP1A2 P05177 2/20 0.63
▸ CYP2C9 P11712 2/20 0.63
▸ HPGD P15428 2/20 0.63
▸ CYP2C19 P33261 2/20 0.63
▸ CYP3A4 P08684 1/20 0.63
▸ CYP2D6 P10635 1/20 0.63
▸ HSD17B10 Q99714 1/20 0.63
▸ DGAT1 O75907 2/20 0.61
▸ SOAT1 P35610 1/20 0.61
▸ KCNH2 Q12809 1/20 0.61
▸ PKN1 Q16512 1/20 0.57
▸ PKN2 Q16513 1/20 0.57
▸ CHEK2 O96017 2/20 0.53
▸ CYP11B2 P19099 1/20 0.50
▸ MAPK13 O15264 1/20 0.48
▸ ALOX5 P09917 1/20 0.48
▸ GCGR P47871 1/20 0.48

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
SCHEMBL20982583 0.83 RHEB (0.70) RHEBKDM4EALDH1A1CYP1A2CYP2C9
SCHEMBL24075325 0.82 KDM4E (0.73) KDM4EALDH1A1CYP1A2CYP2C9HPGD
SCHEMBL20535350 0.82 RHEB (1.00) RHEBKDM4EALDH1A1CYP1A2CYP2C9
SCHEMBL3332734 0.82 RHEB (0.69) RHEBKDM4EALDH1A1CYP1A2CYP2C9
SCHEMBL20982510 0.81 PKN1 (0.82) RHEBKDM4EALDH1A1HPGDCYP3A4
SCHEMBL1842081 0.81 RHEB (0.59) RHEBKDM4EALDH1A1CYP1A2CYP2C9
SCHEMBL24075316 0.80 KDM4E (0.69) KDM4EALDH1A1CYP1A2CYP2C9HPGD
SCHEMBL24075246 0.80 ALDH1A1 (0.69) KDM4EALDH1A1CYP1A2CYP2C9HPGD
SCHEMBL198014 0.80 ALDH1A1 (0.69) RHEBKDM4EALDH1A1CYP1A2CYP2C9
SCHEMBL38658270 0.80 ALDH1A1 (0.69) KDM4EALDH1A1CYP1A2CYP2C9HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230192626-A1 NOVEL SOLUBLE EPOXIDE HYDROLASE INHIBITORS AND METHOD OF USE THEREOF BAYLOR COLLEGE OF MEDICINE (US) 2023-06-22 — — US disclosed
US-20230192626-A1 NOVEL SOLUBLE EPOXIDE HYDROLASE INHIBITORS AND METHOD OF USE THEREOF BAYLOR COLLEGE OF MEDICINE (US) 2023-06-22 — — US disclosed
US-20230192626-A1 NOVEL SOLUBLE EPOXIDE HYDROLASE INHIBITORS AND METHOD OF USE THEREOF BAYLOR COLLEGE OF MEDICINE (US) 2023-06-22 — — US disclosed
WO-2021242790-A1 NOVEL SOLUBLE EPOXIDE HYDROLASE INHIBITORS AND METHOD OF USE THEREOF BAYLOR COLLEGE OF MEDICINE (US) 2021-12-02 — — 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-20230192626-A1 NOVEL SOLUBLE EPOXIDE HYDROLASE INHIBITORS AND METHOD OF USE THEREOF EPHX1, EPHX2, NCEH1 RHEB 1868/4885KDM4E 1761/4885ALDH1A1 588/4885

“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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