SCHEMBL8235168

SCHEMBL8235168

O=C1C(Br)=C(c2ccc(C(F)(F)F)cc2)c2ccc(O)cc21

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 15/20 0.57
ESR1 P03372 14/20 0.57
KIF11 P52732 1/20 0.46
MAOA P21397 1/20 0.43
UGT1A1 P22309 1/20 0.43
MAOB P27338 1/20 0.43
ALKBH3 Q96Q83 1/20 0.38

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
SCHEMBL8234582 0.84 ESR2 (0.62) ESR2ESR1MAOAUGT1A1MAOB
SCHEMBL8242608 0.81 ESR2 (0.62) ESR2ESR1MAOAUGT1A1MAOB
SCHEMBL8215899 0.80 ESR2 (0.69) ESR2ESR1MAOAUGT1A1MAOB
SCHEMBL8234168 0.78 BACE1 (0.46) ESR2ESR1KIF11MAOBALKBH3
SCHEMBL8242350 0.78 ESR2 (0.54) ESR2ESR1MAOAUGT1A1MAOB
SCHEMBL11080070 0.75 ESR2 (0.61) ESR2ESR1KIF11MAOAUGT1A1
SCHEMBL8236050 0.74 ESR2 (0.50) ESR2ESR1MAOAUGT1A1MAOB
SCHEMBL3923444 0.73 ESR2 (1.00) ESR2ESR1MAOAUGT1A1MAOB
SCHEMBL11076399 0.72 ESR2 (0.62) ESR2ESR1KIF11MAOAUGT1A1
SCHEMBL6067861 0.71 KIF11 (0.63) ESR2ESR1KIF11

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
US-8877747-B2 Indenone derivative and pharmaceutical composition comprising same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2014-11-04 US disclosed
EP-2475649-B1 INDENONE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME KOREA RES INST CHEM TECH (KR) 2014-08-13 EP disclosed
US-20120214991-A1 Indenone Derivative and Pharmaceutical Composition Comprising Same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2012-08-23 US disclosed
EP-2475649-A1 INDENONE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Korea Research Institute Of Chemical Technology (KR) 2012-07-18 EP disclosed
WO-2011030955-A1 INDENONE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2011-03-17 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-20120214991-A1 Indenone Derivative and Pharmaceutical Composition Comprising Same INSR, HSD17B7, SOST ESR2 325/4885ESR1 1113/4885KIF11 2283/4885

“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.