SCHEMBL1237349

SCHEMBL1237349

CCc1cc2c(cc1O)CCC1C2CCC2(C)C(=CCOC)CCC12

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 12/20 0.68
CYP19A1 P11511 7/20 0.53
ESR1 P03372 3/20 0.53
STS P08842 2/20 0.51
ESR2 Q92731 1/20 0.48

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
SCHEMBL1237347 1.00 HSD17B1 (0.68) HSD17B1CYP19A1ESR1STSESR2
SCHEMBL12888928 1.00 HSD17B1 (0.68) HSD17B1CYP19A1ESR1STSESR2
SCHEMBL12888950 0.89 HSD17B1 (0.72) HSD17B1CYP19A1ESR1STSESR2
SCHEMBL1234800 0.89 HSD17B1 (0.72) HSD17B1CYP19A1ESR1STSESR2
SCHEMBL12888948 0.89 HSD17B1 (0.72) HSD17B1CYP19A1ESR1STSESR2
SCHEMBL12888897 0.87 HSD17B1 (0.74) HSD17B1CYP19A1ESR1STSESR2
SCHEMBL5000982 0.87 HSD17B1 (0.74) HSD17B1CYP19A1ESR1STSESR2
SCHEMBL12904411 0.84 STS (0.51) HSD17B1CYP19A1ESR1STS
SCHEMBL12904595 0.84 HSD17B1 (0.70) HSD17B1CYP19A1ESR1STSESR2
SCHEMBL12888935 0.84 HSD17B1 (0.70) HSD17B1CYP19A1ESR1STSESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7893284-B2 Oestrogen derivatives as inhibitors of steroid sulphatase STERIX LIMITED (GB) 2011-02-22 US disclosed
EP-1608671-B1 OESTROGEN DERIVATIVES AS INHIBITORS OF STEROID SULPHATASE STERIX LTD (GB) 2010-01-06 EP disclosed
US-20060094696-A1 Oestrogen derivatives as inhibitors of steroid sulphatase STERIX LIMITED (GB) 2006-05-04 US disclosed
EP-1608671-A1 OESTROGEN DERIVATIVES AS INHIBITORS OF STEROID SULPHATASE Sterix Limited (GB) 2005-12-28 EP disclosed
WO-2004085459-A1 OESTROGEN DERIVATIVES AS INHIBITORS OF STEROID SULPHATASE STERIX LIMITED (GB) 2004-10-07 WO 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-20060094696-A1 Oestrogen derivatives as inhibitors of steroid sulphatase HSD17B11, ESRRA, ESRRB HSD17B1 21/4885CYP19A1 9/4885ESR1 6/4885

“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.