SCHEMBL26466869

SCHEMBL26466869

Cc1cncc(Cc2cc(C)cc(C)c2)c1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 18/20 0.51
CYP11B2 P19099 18/20 0.51
CYP3A4 P08684 1/20 0.51

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
SCHEMBL13559004 0.93 CYP11B1 (0.45) CYP11B1CYP11B2CYP3A4
SCHEMBL21251416 0.83 CYP11B1 (0.57) CYP11B1CYP11B2CYP3A4
SCHEMBL19540958 0.81 CYP11B1 (0.51) CYP11B1CYP11B2CYP3A4
SCHEMBL22474091 0.81 CYP11B1 (0.64) CYP11B1CYP11B2CYP3A4
SCHEMBL3588189 0.80 IDH1 (0.46) CYP11B1CYP11B2
Hydrochloric Acid SCHEMBL26136027 0.79 CYP11B1 (0.62) CYP11B1CYP11B2CYP3A4
SCHEMBL20179618 0.78 TUBB4A (0.47) CYP11B1CYP11B2CYP3A4
SCHEMBL24225 0.77
SCHEMBL22180869 0.77 CYP11B1 (0.44) CYP11B1CYP11B2CYP3A4
SCHEMBL30768308 0.76

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-20230138901-A1 COMPOUND HAVING KHK INHIBITORY EFFECT HANGZHOU ZHONGMEIHUADONG PHARMACEUTICAL CO., LTD. (CN) 2023-05-04 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-20230138901-A1 COMPOUND HAVING KHK INHIBITORY EFFECT KHK, KHDRBS1, KHSRP CYP11B1 626/4885CYP11B2 614/4885CYP3A4 4641/4885

“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.