SCHEMBL5949236

SCHEMBL5949236

Oc1ccc(F)c(-c2c(F)c(F)c(O)c(F)c2F)c1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 13/20 0.38
▸ ESR2 Q92731 10/20 0.38
▸ KDM1A O60341 1/20 0.36
▸ MAOA P21397 1/20 0.35
▸ UGT1A1 P22309 1/20 0.35
▸ MAOB P27338 1/20 0.35
▸ CHEK1 O14757 1/20 0.35
▸ WEE1 P30291 1/20 0.35
▸ TTR P02766 1/20 0.34
▸ ADRA2A P08913 1/20 0.33
▸ ADRA2B P18089 1/20 0.33
▸ ADRA2C P18825 1/20 0.33
▸ HSD17B1 P14061 1/20 0.32
▸ HSD17B2 P37059 1/20 0.32

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
SCHEMBL25420071 0.83 TTR (0.42) ESR1ESR2MAOAUGT1A1MAOB
SCHEMBL5948946 0.83 ESR1 (0.52) ESR1ESR2HSD17B1HSD17B2
SCHEMBL5948451 0.80 ESR1 (0.48) ESR1ESR2HSD17B1HSD17B2
SCHEMBL25422634 0.80 TTR (0.40) ESR1ESR2MAOAUGT1A1MAOB
SCHEMBL25421166 0.78 TTR (0.41) ESR1ESR2MAOAUGT1A1MAOB
SCHEMBL25419103 0.77 TAAR1 (0.34) ESR1ESR2
SCHEMBL5949079 0.77 TAAR1 (0.34) ESR1ESR2
SCHEMBL25422120 0.75 TTR (0.42) ESR1ESR2MAOAUGT1A1MAOB
SCHEMBL29001442 0.74 ALDH1A1 (0.42) ESR1ESR2MAOAUGT1A1MAOB
SCHEMBL30310822 0.74 ALDH1A1 (0.42) ESR1ESR2MAOAUGT1A1MAOB

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-7034173-B2 Chemical products suited for use as co-catalysts, method for the preparation thereof and their use in catalyst systems for producing polyolefins BASELL POLYOLEFINE GMBH (DE) 2006-04-25 — — US disclosed
US-20030144434-A1 Chemical products suited for use as co-catalysts, method for the preparation thereof and their use in catalyst systems for producing polyolefins EQUISTAR CHEMICALS, LP 2003-07-31 — — 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-20030144434-A1 Chemical products suited for use as co-catalysts, method for the preparation thereof and their use in catalyst systems for producing polyolefins CBR1, COX6C, CBR3 ESR1 4091/4885ESR2 2428/4885KDM1A 1602/4885

“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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