SCHEMBL13327484

SCHEMBL13327484

CC=C1C(O)CC2C3CCC4=CC(O)CC[C@]4(C)C3CC[C@]12C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 8/20 0.60
▸ SHBG P04278 2/20 0.58
▸ ESR1 P03372 3/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ AR P10275 3/20 0.40
▸ MAPT P10636 3/20 0.40
▸ NR1I2 O75469 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ NR3C1 P04150 2/20 0.40
▸ PGR P06401 2/20 0.40
▸ NR3C2 P08235 2/20 0.40
▸ CYP3A4 P08684 2/20 0.40
▸ NR1H4 Q96RI1 2/20 0.40
▸ MAPK1 P28482 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ VDR P11473 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ RXRA P19793 1/20 0.40
▸ PPARG P37231 1/20 0.40

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
SCHEMBL13327487 1.00 CYP19A1 (0.60) CYP19A1SHBGESR1SMN1; SMN2AR
SCHEMBL3338391 1.00 CYP19A1 (0.60) CYP19A1SHBGESR1SMN1; SMN2AR
SCHEMBL7145526 1.00 CYP19A1 (0.60) CYP19A1SHBGESR1SMN1; SMN2AR
SCHEMBL12153460 0.82 SMN1; SMN2 (0.63) CYP19A1SHBGESR1SMN1; SMN2AR
SCHEMBL13327143 0.82 SMN1; SMN2 (0.63) CYP19A1SHBGESR1SMN1; SMN2AR
SCHEMBL12153534 0.82 SMN1; SMN2 (0.63) CYP19A1SHBGESR1SMN1; SMN2AR
SCHEMBL12153584 0.82 SMN1; SMN2 (0.63) CYP19A1SHBGESR1SMN1; SMN2AR
SCHEMBL12858782 0.82 SMN1; SMN2 (0.63) CYP19A1SHBGESR1SMN1; SMN2AR
SCHEMBL13327141 0.82 SMN1; SMN2 (0.63) CYP19A1SHBGESR1SMN1; SMN2AR
SCHEMBL13304378 0.82 SMN1; SMN2 (0.63) CYP19A1SHBGESR1SMN1; SMN2AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100151002-A1 Guggulphospholipid Methods and Compositions JINA PHARMACEUTICALS, INC. (US) 2010-06-17 — — 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-20100151002-A1 Guggulphospholipid Methods and Compositions SGMS2, SGMS1, PLA2G5 CYP19A1 406/4885SHBG 227/4885ESR1 708/4885

“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.

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