SCHEMBL23772147

SCHEMBL23772147

CC(C)c1ccc(C(n2cncn2)n2cncn2)cc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 18/20 0.53
CYP11B1 P15538 2/20 0.45
CYP3A4 P08684 1/20 0.45
TSHR P16473 1/20 0.45
CYP11B2 P19099 1/20 0.45
CYP2C19 P33261 1/20 0.45
CYP26A1 O43174 1/20 0.41

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
SCHEMBL23772146 0.80 CYP19A1 (0.45) CYP19A1CYP11B1CYP3A4TSHRCYP11B2
SCHEMBL1619037 0.73 SMN1; SMN2 (0.55) CYP19A1CYP2C19
SCHEMBL10565254 0.72 CYP19A1 (0.65) CYP19A1CYP11B1CYP3A4
SCHEMBL4051634 0.72 CYP19A1 (0.44) CYP19A1CYP11B1CYP3A4TSHRCYP11B2
SCHEMBL1371558 0.69
SCHEMBL9367742 0.69 CYP19A1 (0.61) CYP19A1CYP11B1CYP3A4
SCHEMBL11228301 0.69 CYP19A1 (0.67) CYP19A1CYP11B1CYP3A4TSHRCYP11B2
SCHEMBL14414182 0.69 CYP19A1 (0.68) CYP19A1CYP11B1CYP3A4TSHRCYP11B2
SCHEMBL9913662 0.69 CYP19A1 (0.68) CYP19A1CYP11B1CYP3A4TSHRCYP11B2
SCHEMBL10022380 0.69 CYP19A1 (0.61) CYP19A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11679093-B2 2-naphthimidamides, analogues thereof, and methods of treatment using same THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2023-06-20 US disclosed
US-20210251942-A1 2-NAPHTHIMIDAMIDES, ANALOGUES THEREOF, AND METHODS OF TREATMENT USING SAME UNIV COLORADO REGENTS (US) 2021-08-19 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 (2 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-11679093-B2 2-naphthimidamides, analogues thereof, and methods of treatment using same TMPRSS2, TMPRSS4, TMPRSS15 CYP19A1 3866/4885CYP11B1 4395/4885CYP3A4 2284/4885
US-20210251942-A1 2-NAPHTHIMIDAMIDES, ANALOGUES THEREOF, AND METHODS OF TREATMENT USING SAME TMPRSS2, TMPRSS4, TMPRSS15 CYP19A1 3866/4885CYP11B1 4395/4885CYP3A4 2284/4885

“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.