SCHEMBL5118811

SCHEMBL5118811

CC1(C)CC(=NO)c2ccc(-c3cc(Cl)ccc3Cl)cc21

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PGR P06401 4/20 0.46
HTT P42858 4/20 0.39
CNR2 P34972 2/20 0.34
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
CXCR3 P49682 1/20 0.32
CNR1 P21554 1/20 0.32
PDK2 Q15119 2/20 0.32
LMNA P02545 1/20 0.32
TDP2 O95551 1/20 0.31
PTGS2 P35354 1/20 0.30
RORC P51449 1/20 0.30

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
SCHEMBL5118804 1.00 PGR (0.46) PGRHTTCNR2ALDH1A1HPGD
SCHEMBL5117651 0.91 PGR (0.45) PGRHTTCNR2CNR1LMNA
SCHEMBL5117659 0.91 PGR (0.45) PGRHTTCNR2CNR1LMNA
SCHEMBL5113573 0.88 PGR (0.49) PGRHTTCNR2CNR1PDK2
SCHEMBL5113579 0.88 PGR (0.49) PGRHTTCNR2CNR1PDK2
SCHEMBL5118537 0.85 PDK2 (0.46) PGRHTTPDK2
SCHEMBL5118544 0.85 PDK2 (0.46) PGRHTTPDK2
SCHEMBL5124400 0.85 PGR (0.63) PGRHTTTDP2
SCHEMBL5124405 0.85 PGR (0.63) PGRHTTTDP2
SCHEMBL5122784 0.83 PGR (0.65) PGRPDK2TDP2

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-7414142-B2 5-aryl-indan-1-one oximes and analogs useful as progesterone receptor modulators WYETH (US) 2008-08-19 US disclosed
US-20070066637-A1 5-Aryl-indan-1-one oximes and analogs useful as progesterone receptor modulators WYETH (US) 2007-03-22 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-20070066637-A1 5-Aryl-indan-1-one oximes and analogs useful as progesterone receptor modulators CYP19A1, PGR, GNRHR PGR 2/4885HTT 4288/4885CNR2 295/4885

“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.