SCHEMBL7520550

SCHEMBL7520550

CC[C@@]12CCC[C@H]1[C@@H]1CC(=O)C3=CC(=O)CC[C@]3(C)[C@H]1CC2

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 16/20 0.64
SMN1; SMN2 Q16637 2/20 0.41
NR1I2 O75469 1/20 0.41
ALDH1A1 P00352 1/20 0.41
ESR1 P03372 1/20 0.41
NR3C1 P04150 1/20 0.41
TP53 P04637 1/20 0.41
PGR P06401 1/20 0.41
NR3C2 P08235 1/20 0.41
CYP3A4 P08684 1/20 0.41
AR P10275 1/20 0.41
VDR P11473 1/20 0.41
TSHR P16473 1/20 0.41
RXRA P19793 1/20 0.41
MAPK1 P28482 1/20 0.41
PPARG P37231 1/20 0.41
NR1H2 P55055 1/20 0.41
PPARA Q07869 1/20 0.41
NR1H4 Q96RI1 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL1900487 0.83 CYP19A1 (0.70) CYP19A1SMN1; SMN2NR1I2ALDH1A1ESR1
SCHEMBL1900489 0.83 CYP19A1 (0.70) CYP19A1SMN1; SMN2NR1I2ALDH1A1ESR1
SCHEMBL3639319 0.82 CYP19A1 (0.63) CYP19A1SMN1; SMN2NR1I2ALDH1A1ESR1
SCHEMBL42713 0.78 CYP19A1 (1.00) CYP19A1SMN1; SMN2ALDH1A1TSHRMAPK1
SCHEMBL2600419 0.78 CYP19A1 (1.00) CYP19A1SMN1; SMN2ALDH1A1TSHRMAPK1
SCHEMBL42712 0.78 CYP19A1 (1.00) CYP19A1SMN1; SMN2ALDH1A1TSHRMAPK1
SCHEMBL6821320 0.77 CYP19A1 (0.78) CYP19A1SMN1; SMN2ALDH1A1TSHRMAPK1
SCHEMBL7097095 0.77 CYP19A1 (0.78) CYP19A1SMN1; SMN2ALDH1A1TSHRMAPK1
SCHEMBL11425175 0.76 CYP19A1 (0.64) CYP19A1NR1I2NR3C1PGRCYP3A4
SCHEMBL7882955 0.76 CYP19A1 (0.64) CYP19A1

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-20020103391-A1 Novel androstanes for inducing hypothalamic effects BERLINER DAVID L (US) 2002-08-01 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-20020103391-A1 Novel androstanes for inducing hypothalamic effects FABP7, NR3C2, NR3C1 CYP19A1 109/4885SMN1; SMN2 4660/4885NR1I2 40/4885

“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.