SCHEMBL6577636

SCHEMBL6577636

C[C@]12CC=C(O)CC1CC[C@@H]1[C@@H]2CC[C@]2(C)C(O)CC[C@@H]12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 3/20 0.59
SHBG P04278 3/20 0.59
CYP3A4 P08684 3/20 0.59
SERPINA6 P08185 2/20 0.59
HSD17B10 Q99714 2/20 0.59
CYP19A1 P11511 2/20 0.59
NR3C1 P04150 1/20 0.59
PGR P06401 1/20 0.59
NR3C2 P08235 1/20 0.59
AR P10275 1/20 0.59
MGAM O43451 1/20 0.59
PDK1 Q15118 2/20 0.56
PDK2 Q15119 2/20 0.56
PDK3 Q15120 2/20 0.56
PDK4 Q16654 2/20 0.56
LMNA P02545 3/20 0.55
CYP1A2 P05177 2/20 0.55
CYP2C9 P11712 2/20 0.55
CYP2C19 P33261 2/20 0.55
TSHR P16473 1/20 0.55

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
SCHEMBL11516238 1.00 GPBAR1 (0.59) GPBAR1SHBGCYP3A4SERPINA6HSD17B10
SCHEMBL3842363 1.00 GPBAR1 (0.59) GPBAR1SHBGCYP3A4SERPINA6HSD17B10
SCHEMBL11043325 0.86 GPBAR1 (0.59) GPBAR1SHBGCYP3A4SERPINA6HSD17B10
SCHEMBL11043329 0.86 GPBAR1 (0.59) GPBAR1SHBGCYP3A4SERPINA6HSD17B10
SCHEMBL6446959 0.85 GPBAR1 (0.43) GPBAR1SHBGCYP3A4SERPINA6HSD17B10
SCHEMBL6434159 0.85 GPBAR1 (0.43) GPBAR1SHBGCYP3A4SERPINA6HSD17B10
SCHEMBL497888 0.85 GPBAR1 (0.43) GPBAR1SHBGCYP3A4SERPINA6HSD17B10
SCHEMBL9310044 0.83 GRIN1 (0.48) GPBAR1SHBGCYP3A4SERPINA6HSD17B10
SCHEMBL11150042 0.82 SRD5A2 (0.59) GPBAR1CYP3A4LMNACYP1A2CYP2C9
SCHEMBL1235822 0.82 AKR1B10 (0.63) GPBAR1CYP3A4LMNACYP1A2CYP2C9

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
EP-1404344-A2 BONE ANABOLIC COMPOUNDS AND METHODS OF USE Anabonix, Inc. (US) 2004-04-07 EP claimed
WO-2003002058-A2 BONE ANABOLIC COMPOUNDS AND METHODS OF USE ANABONIX, INC. (US) 2003-01-09 WO claimed
US-11730682-B2 Self-standing cosmetic sheet L'OREAL (FR) 2023-08-22 US disclosed
EP-1414390-A1 NANOCAPSULES CONTAINING A STEROID FOR COSMETIC COMPOSITIONS L'OREAL (FR) 2004-05-06 EP disclosed
WO-2003013445-A1 NANOCAPSULES CONTAINING A STEROID FOR COSMETIC COMPOSITIONS L'OREAL (FR) 2003-02-20 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-11730682-B2 Self-standing cosmetic sheet CUTA, DSG1, SUCLG1 GPBAR1 4596/4885SHBG 554/4885CYP3A4 3902/4885

“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.