SCHEMBL3369293

SCHEMBL3369293

Fc1ccc2c(c1)CCc1cc(F)ccc1C2=S

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 13/20 0.46
CYP19A1 P11511 10/20 0.46
CYP11B1 P15538 10/20 0.46
SRD5A1 P18405 2/20 0.46
PARP1 P09874 1/20 0.36
PARP10 Q53GL7 1/20 0.36
MAPK14 Q16539 1/20 0.36

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
SCHEMBL3372953 0.77 SRD5A1 (0.54) CYP11B2CYP19A1CYP11B1SRD5A1PARP1
SCHEMBL13849161 0.77 CYP11B2 (0.46) CYP11B2CYP19A1CYP11B1SRD5A1PARP1
SCHEMBL4574918 0.76 CYP11B2 (0.45) CYP11B2CYP19A1CYP11B1SRD5A1PARP1
SCHEMBL192610 0.76 CASP1 (0.59) CYP11B2CYP19A1CYP11B1SRD5A1
SCHEMBL29726050 0.76 CASP1 (0.59) CYP11B2CYP19A1CYP11B1SRD5A1
SCHEMBL8252930 0.76 CYP11B2 (0.45) CYP11B2CYP19A1CYP11B1SRD5A1PARP1
SCHEMBL7665011 0.74 PARP10 (0.46) CYP11B2CYP19A1CYP11B1SRD5A1PARP10
SCHEMBL3369697 0.73 HTT (0.55) CYP11B2CYP19A1CYP11B1SRD5A1PARP1
SCHEMBL15395903 0.72 CYP11B2 (0.42) CYP11B2CYP19A1CYP11B1SRD5A1PARP1
SCHEMBL4045716 0.72 CYP11B2 (0.46) CYP11B2CYP19A1CYP11B1SRD5A1PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1716132-B1 SPIRO-BENZODIOXOLES AND THEIR USE AS CB1 ANTAGONISTS HOFFMANN LA ROCHE (CH) 2010-08-25 EP disclosed
US-7144890-B2 Spiro-pentacyclic compounds HOFFMAN-LA ROCHE INC. (US) 2006-12-05 US disclosed
US-20050165012-A1 Spiro-pentacyclic compounds HOFFMANN-LA ROCHE INC. 2005-07-28 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-20050165012-A1 Spiro-pentacyclic compounds CNR1, CNR2, GPR119 CYP11B2 134/4885CYP19A1 212/4885CYP11B1 101/4885

“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.