SCHEMBL4665668

SCHEMBL4665668

CCC(=C(Br)Br)c1cccc(/C=C/C(=O)O)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 12/20 0.55
ESR2 Q92731 3/20 0.55
PGR P06401 2/20 0.55
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
PTGS2 P35354 1/20 0.50
NPSR1 Q6W5P4 1/20 0.49
PKM P14618 1/20 0.48
HDAC3 O15379 1/20 0.46
TNKS O95271 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HCAR2 Q8TDS4 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
TNKS2 Q9H2K2 1/20 0.46

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
SCHEMBL4665675 1.00 ESR1 (0.55) ESR1ESR2PGRKDM4EALDH1A1
SCHEMBL4886174 0.84 TTR (0.52) KDM4EALDH1A1SMN1; SMN2PTGS2PKM
SCHEMBL4886183 0.84 TTR (0.52) KDM4EALDH1A1SMN1; SMN2PTGS2PKM
SCHEMBL4667601 0.82 ALDH1A1 (0.57) ESR1ESR2PGRKDM4EALDH1A1
SCHEMBL4667605 0.82 ALDH1A1 (0.57) ESR1ESR2PGRKDM4EALDH1A1
SCHEMBL4888695 0.81 ESR1 (0.77) ESR1ESR2PGR
SCHEMBL4888684 0.81 ESR1 (0.77) ESR1ESR2PGR
SCHEMBL14026083 0.80 ESR1 (0.66) ESR1ESR2PGR
SCHEMBL4886191 0.79 EPHX2 (0.53) ESR1ESR2PGRKDM4EALDH1A1
SCHEMBL4668973 0.78 ESR1 (0.63) ESR1ESR2PGR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255078-A1 Triphenylethylene Compounds Useful as Selective Estrogen Receptor Modulators KATAMREDDY SUBBA REDDY 2008-10-16 US disclosed
EP-1951216-A2 CHEMICAL COMPOUNDS SmithKline Beecham Corporation (US) 2008-08-06 EP disclosed
WO-2007062145-A2 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2007-05-31 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-20080255078-A1 Triphenylethylene Compounds Useful as Selective Estrogen Receptor Modulators GPER1, ESR2, ESRRG ESR1 4/4885ESR2 2/4885PGR 9/4885

“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.