Raloxifene

Raloxifene

SCHEMBL1665291

Cl.O=C(c1ccc(OCCN2CCCCC2)cc1)c1c(-c2ccc(O)cc2)sc2cc(O)ccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ESR1ESR2

The experimentally established mechanism targets of Raloxifene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 known ✓ P03372 20/20 1.00
ESR2 known ✓ Q92731 19/20 1.00
MEN1 O00255 2/20 1.00
ALDH1A1 P00352 2/20 1.00
LMNA P02545 2/20 1.00
TP53 P04637 2/20 1.00
CYP3A4 P08684 2/20 1.00
MAPT P10636 2/20 1.00
ALOX15 P16050 2/20 1.00
KMT2A Q03164 2/20 1.00
HSD17B10 Q99714 2/20 1.00
TDP1 Q9NUW8 2/20 1.00
GMNN O75496 1/20 1.00
HLA-A P04439 1/20 1.00
HTT P42858 1/20 1.00
BLM P54132 1/20 1.00
UBE2N P61088 1/20 1.00
PMP22 Q01453 1/20 1.00
NPSR1 Q6W5P4 1/20 1.00
PLD2 O14939 1/20 0.98

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
Raloxifene SCHEMBL178172 1.00 ESR1 (1.00) ESR1ESR2MEN1ALDH1A1LMNA
Raloxifene SCHEMBL12485521 1.00 ESR1 (1.00) ESR1ESR2MEN1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL9201404 1.00 ESR1 (1.00) ESR1ESR2MEN1ALDH1A1LMNA
Raloxifene SCHEMBL19077 1.00 ESR1 (1.00) ESR1ESR2MEN1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL7631648 0.99 ESR1 (0.98) ESR1ESR2MEN1ALDH1A1LMNA
Raloxifene SCHEMBL975023 0.99 ESR1 (0.98) ESR1ESR2MEN1ALDH1A1LMNA
Raloxifene SCHEMBL3162158 0.99 ESR1 (1.00) ESR1ESR2MEN1ALDH1A1LMNA
Ly-117018 SCHEMBL7080240 0.99 ESR1 (0.98) ESR1ESR2MEN1ALDH1A1LMNA
Raloxifene SCHEMBL6144 0.99 ESR1 (1.00) ESR1ESR2MEN1ALDH1A1LMNA
Raloxifene SCHEMBL9145135 0.99 ESR1 (1.00) ESR1ESR2MEN1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117964602-A Benzothiophene ketone derivative and preparation method and application thereof 广州医科大学 2024-05-03 CN claimed
CN-117964602-A Benzothiophene ketone derivative and preparation method and application thereof 广州医科大学 2024-05-03 CN disclosed
CN-116327482-A Apparatus and method for ocular injection 科尼尔赛德生物医学公司 2023-06-27 CN disclosed
CN-110302004-B Apparatus and method for ocular injection 科尼尔赛德生物医学公司 2023-04-28 CN disclosed
EP-3803402-B1 ANTI-CANCER TREATMENT OF PRESELECTED SUBJECTS AND SCREENING METHODS TO IDENTIFY SUSCEPTIBLE SUBJECTS TUDAG TU DRESDEN AG (DE) 2023-04-26 EP disclosed
US-11576891-B2 Methods of treating or preventing estrogen-related diseases ENDORECHERCHE, INC. 2023-02-14 US disclosed
US-11452731-B2 Method of treating and preventing loss of cognition ENDORECHERCHE, INC. 2022-09-27 US disclosed
CN-106687128-B Compositions and methods for treating metabolic disorders NGM生物制药有限公司 2022-05-10 CN disclosed
EP-2314581-B1 A process for preparing benzo[b]thiophene derivatives HEXAL AG (DE) 2012-07-25 EP disclosed
EP-2322519-A1 A process for preparing benzo[b]thiophene derivatives Hexal AG (DE) 2011-05-18 EP disclosed
WO-2011047878-A2 A PROCESS FOR PREPARING BENZO[B]THIOPHENE DERIVATIVES HEXAL AKTIENGESELLSCHAFT (DE) 2011-04-28 WO disclosed
WO-2011047877-A1 A PROCESS FOR PREPARING BENZO[B]THIOPHENE DERIVATIVES HEXAL AKTIENGESELLSCHAFT (DE) 2011-04-28 WO disclosed
EP-2314581-A1 A process for preparing benzo[b]thiophene derivatives Hexal AG (DE) 2011-04-27 EP 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 (2 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-11452731-B2 Method of treating and preventing loss of cognition SHBG, BRCA1, CYP19A1 ESR1 11/4885ESR2 6/4885MEN1 196/4885
US-11576891-B2 Methods of treating or preventing estrogen-related diseases SHBG, ESRRA, ESR2 ESR1 8/4885ESR2 3/4885MEN1 3108/4885

“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.