SCHEMBL5116863

SCHEMBL5116863

CC1(C)C/C(=N\O)c2ccc(-c3cccc(C(F)(F)F)c3)cc21

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PGR P06401 4/20 0.43
PARP10 Q53GL7 1/20 0.43
PARP11 Q9NR21 1/20 0.43
KDM1A O60341 1/20 0.41
BACE1 P56817 4/20 0.41
BACE2 Q9Y5Z0 1/20 0.41
KIF11 P52732 1/20 0.40
S1PR5 Q9H228 1/20 0.40
ASIC3 Q9UHC3 1/20 0.40
MAOB P27338 1/20 0.39
CTSD P07339 1/20 0.39
AKR1C3 P42330 2/20 0.38
AKR1C2 P52895 2/20 0.38
PDK2 Q15119 2/20 0.37

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
SCHEMBL5116870 1.00 PGR (0.43) PGRPARP10PARP11KDM1ABACE1
SCHEMBL5116847 0.90 TDP2 (0.44) PGRKIF11PDK2
SCHEMBL5116853 0.90 TDP2 (0.44) PGRKIF11PDK2
SCHEMBL5114379 0.84 PGR (0.48) PGRPARP10PARP11MAOBPDK2
SCHEMBL5114381 0.84 PGR (0.48) PGRPARP10PARP11MAOBPDK2
SCHEMBL5118116 0.82 PGR (0.64) PGRPARP10PARP11PDK2
SCHEMBL5118108 0.82 PGR (0.64) PGRPARP10PARP11PDK2
SCHEMBL5122784 0.81 PGR (0.65) PGRPARP10PARP11PDK2
SCHEMBL5122796 0.81 PGR (0.65) PGRPARP10PARP11PDK2
SCHEMBL4418284 0.81 PGR (0.67) PGRPARP10PARP11KDM1ABACE1

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 2/4885PARP10 1100/4885PARP11 1327/4885

“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.