SCHEMBL9290697

SCHEMBL9290697

C=CC[C@]1(C)CC(O)CCC1(C)C

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.33
AR P10275 1/20 0.33
ESR2 Q92731 1/20 0.33
GPBAR1 Q8TDU6 1/20 0.31

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
SCHEMBL10261186 1.00 ESR1 (0.33) ESR1ARESR2GPBAR1
SCHEMBL6848651 1.00 ESR1 (0.33) ESR1ARESR2GPBAR1
SCHEMBL10261122 1.00 ESR1 (0.33) ESR1ARESR2GPBAR1
SCHEMBL10261589 0.76
SCHEMBL6847773 0.76
SCHEMBL12020170 0.75 ESR1 (0.35) ESR1ARESR2GPBAR1
SCHEMBL15809885 0.75 ESR1 (0.35) ESR1ARESR2GPBAR1
SCHEMBL6847786 0.73
SCHEMBL10260783 0.73
SCHEMBL20280526 0.71

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-20120172348-A1 STEROL DERIVATIVE KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-07-05 US disclosed
EP-2457923-A1 STEROL DERIVATIVE Kyowa Hakko Kirin Co., Ltd. (JP) 2012-05-30 EP 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-20120172348-A1 STEROL DERIVATIVE NR1H3, NR1H2, SREBF1 ESR1 491/4885AR 141/4885ESR2 153/4885

“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.