SCHEMBL6364171

SCHEMBL6364171

CCN(CC)S(=O)(=O)Oc1ccc2c(c1)CCC1C2CC[C@@]2(C)C1CC[C@@H]2O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCC4 O15439 2/20 0.75
ABCC1 P33527 1/20 0.75
STS P08842 4/20 0.74
KDM4E B2RXH2 1/20 0.74
LMNA P02545 5/20 0.71
HSD17B10 Q99714 5/20 0.71
ESR1 P03372 5/20 0.67
SMN1; SMN2 Q16637 3/20 0.67
ADORA3 P0DMS8 2/20 0.67
ATM Q13315 2/20 0.67
PGR P06401 2/20 0.67
AR P10275 2/20 0.67
SLC6A3 Q01959 2/20 0.67
CHRM1 P11229 1/20 0.67
TBXA2R P21731 1/20 0.67
ADRA1A P35348 1/20 0.67
OPRM1 P35372 1/20 0.67
RECQL P46063 2/20 0.64
BLM P54132 2/20 0.64
ALDH1A1 P00352 2/20 0.62

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
SCHEMBL4395104 1.00 ABCC4 (0.75) ABCC4ABCC1STSKDM4ELMNA
SCHEMBL4382857 0.89 ABCC4 (0.80) ABCC4ABCC1STSKDM4ELMNA
SCHEMBL6364570 0.89 ABCC4 (0.80) ABCC4ABCC1STSKDM4ELMNA
SCHEMBL15942368 0.89 ABCC4 (0.70) ABCC4ABCC1STSKDM4ELMNA
SCHEMBL6364269 0.88 USP2 (0.63) ABCC4ABCC1STSKDM4ELMNA
SCHEMBL3370188 0.88 USP2 (0.63) ABCC4ABCC1STSKDM4ELMNA
SCHEMBL30471686 0.86 ABCC4 (1.00) ABCC4ABCC1STSKDM4ELMNA
SCHEMBL232797 0.86 ABCC4 (1.00) ABCC4ABCC1STSKDM4ELMNA
SCHEMBL29392632 0.86 ABCC4 (1.00) ABCC4ABCC1STSKDM4ELMNA
SCHEMBL232796 0.86 ABCC4 (1.00) ABCC4ABCC1STSKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0775156-B1 PHARMACEUTICAL COMPOSITIONS CONTAINING ESTRA-1,3,5(10)-TRIENE DERIVATIVES JENAPHARM GMBH (DE) 2003-09-03 EP claimed
US-20020061868-A1 Pharmaceutical preparations containing estra-1,3,5(10)-triene derivatives STERIX LIMITED (GB) 2002-05-23 US claimed
US-6841548-B2 Pharmaceutical preparations containing estra-1,3,5(10)-triene derivatives SCHERING AG (DE) 2005-01-11 US disclosed
EP-0775156-B1 PHARMACEUTICAL COMPOSITIONS CONTAINING ESTRA-1,3,5(10)-TRIENE DERIVATIVES JENAPHARM GMBH (DE) 2003-09-03 EP disclosed
US-6569844-B1 Hormonal contraception and hormon replacement therapy with low hepatic estrogenity JENAPHARM GMBH & CO., KG (DE) 2003-05-27 US disclosed
US-20020061868-A1 Pharmaceutical preparations containing estra-1,3,5(10)-triene derivatives STERIX LIMITED (GB) 2002-05-23 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-20020061868-A1 Pharmaceutical preparations containing estra-1,3,5(10)-triene derivatives ESRRA, ESR2, CYP19A1 ABCC4 2078/4885ABCC1 819/4885STS 124/4885

“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.