SCHEMBL11965103

SCHEMBL11965103

Cc1nsc2c1CCc1cc(F)ccc1-2

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 13/20 0.38
CYP19A1 P11511 10/20 0.38
CYP11B1 P15538 10/20 0.38
SRD5A1 P18405 2/20 0.37
DHODH Q02127 1/20 0.33
MAPK10 P53779 1/20 0.33
RIPK1 Q13546 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33

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
SCHEMBL11965104 0.79 CYP1A2 (0.51) CYP11B2CYP19A1
SCHEMBL11965071 0.70 CYP1A2 (0.50) CYP11B2CYP19A1CYP11B1SRD5A1
SCHEMBL7665011 0.68 PARP10 (0.46) CYP11B2CYP19A1CYP11B1SRD5A1
SCHEMBL8252930 0.65 CYP11B2 (0.45) CYP11B2CYP19A1CYP11B1SRD5A1
SCHEMBL1009901 0.64 MAOA (0.50) CYP11B2CYP19A1CYP11B1SRD5A1MAPK10
SCHEMBL23110014 0.64 NOTUM (0.47)
SCHEMBL25501701 0.64 CYP11B1 (0.42) CYP11B2CYP19A1CYP11B1SRD5A1DHODH
SCHEMBL3369293 0.63 CYP11B2 (0.46) CYP11B2CYP19A1CYP11B1SRD5A1
SCHEMBL13849161 0.63 CYP11B2 (0.46) CYP11B2CYP19A1CYP11B1SRD5A1
SCHEMBL3372953 0.63 SRD5A1 (0.54) CYP11B2CYP19A1CYP11B1SRD5A1

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-20120202794-A1 COMPOUNDS PHARMASSET, INC. (US) 2012-08-09 US disclosed
US-20120202794-A1 COMPOUNDS PHARMASSET, INC. (US) 2012-08-09 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-20120202794-A1 COMPOUNDS HAVCR2, MAVS, GOT2 CYP11B2 394/4885CYP19A1 2023/4885CYP11B1 353/4885

“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.