SCHEMBL25564702

SCHEMBL25564702

CC(C)(CCC(C)(C)c1ccc(Cl)cn1)c1ccc(F)cn1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NFE2L2 Q16236 1/20 0.40
▸ FAAH O00519 1/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ CYP3A4 P08684 1/20 0.36
▸ CETP P11597 8/20 0.34
▸ LMNA P02545 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ POLB P06746 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ FFAR2 O15552 1/20 0.33
▸ IDH1 O75874 1/20 0.32
▸ CYP19A1 P11511 1/20 0.32

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
SCHEMBL19115639 0.81 SLC22A12 (0.33) CYP3A4
SCHEMBL19987518 0.81 ALDH1A1 (0.32) —
SCHEMBL22488083 0.79 ALDH1A1 (0.33) NFE2L2CETPCYP19A1
SCHEMBL20466847 0.77 CYP19A1 (0.37) NFE2L2CETPSMN1; SMN2CYP19A1
SCHEMBL18415010 0.77 BRS3 (0.38) KCNH2HTT
SCHEMBL22601465 0.75 CNR2 (0.38) —
SCHEMBL25886965 0.72 NFE2L2 (0.41) NFE2L2FAAHKCNH2CYP3A4CETP
SCHEMBL2609326 0.72 CCR9 (0.40) NFE2L2RAB9AKMT2ASMN1; SMN2CYP19A1
SCHEMBL4729458 0.72 TRPV4 (0.37) CYP3A4
SCHEMBL29649716 0.70 TRPV4 (0.40) FAAHKCNH2CYP3A4

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-20230167099-A1 NEW PYRAZINE COMPOUND Wigen Biomedicine Technology (shanghai) Co., Ltd. (CN) 2023-06-01 — — 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-20230167099-A1 NEW PYRAZINE COMPOUND EGFR, ERBB2, WEE1 NFE2L2 962/4885FAAH 3975/4885KCNH2 2701/4885

“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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