SCHEMBL5725784

SCHEMBL5725784

[c]1ccccc1-c1ccc(OCCOCc2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA4 P43681 1/20 0.40
FOXM1 Q08050 1/20 0.40
GSTP1 P09211 1/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
PTGS1 P23219 1/20 0.39
SLC6A2 P23975 1/20 0.39
CYP2C19 P33261 1/20 0.39
PTGS2 P35354 1/20 0.39
SLC6A3 Q01959 1/20 0.39
HIF1A Q16665 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39

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
SCHEMBL5724800 0.99 FOXM1 (0.42) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL27574044 0.86 LMNA (0.53) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL8161024 0.86 GSTP1 (0.43) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL10713484 0.80 TSHR (0.54) FOXM1GSTP1RAB9ASMN1; SMN2NPC1
SCHEMBL16594362 0.79 TSHR (0.56) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL27574137 0.79 HTR1A (0.50) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL1894536 0.79 ALDH1A1 (0.55) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL27270853 0.78 GSTP1 (0.54) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL5677947 0.78 LMNA (0.62) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL903883 0.78 TSHR (0.58) FOXM1RAB9ASMN1; SMN2NPC1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1705169-A2 Triphenylalkene derivatives and their use as selective estrogen receptor modulators Hormos Medical Ltd. (FI) 2006-09-27 EP disclosed
EP-1235776-B1 TRIPHENYLALKENE DERIVATIVES AND THEIR USE AS SELECTIVE ESTROGEN RECEPTOR MODULATORS HORMOS MEDICAL CORP (FI) 2006-02-08 EP disclosed
US-6875775-B2 Triphenylalkene derivatives and their use as selective estrogen receptor modulators HORMOS MEDICAL OY LTD (FI) 2005-04-05 US disclosed
US-20030225130-A1 Triphenylalkene derivatives and their use as selective estrogen receptor modulators HORMOS MEDICAL OY LTD. 2003-12-04 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-20030225130-A1 Triphenylalkene derivatives and their use as selective estrogen receptor modulators ESR2, ESR1, GPER1 CHRNA7 247/4885CHRNB2 151/4885CHRNB4 165/4885

“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.