SCHEMBL79362

SCHEMBL79362

[c]1c(-c2cccc3cc4ccccc4cc23)ccc2c1ccc1ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.44
HSD17B10 Q99714 4/20 0.44
HIF1A Q16665 2/20 0.44
CYP1B1 Q16678 2/20 0.44
CYP1A2 P05177 3/20 0.41
ERBB2 P04626 1/20 0.41
FYN P06241 1/20 0.41
MAOA P21397 1/20 0.41
ACHE P22303 1/20 0.41
AHR P35869 1/20 0.41
HPGD P15428 3/20 0.39
HPRT1 P00492 3/20 0.38
TSHR P16473 2/20 0.38
SOS1 Q07889 1/20 0.38
MAPK1 P28482 1/20 0.38
CASP1 P29466 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP2A6 P11509 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP1A1 P04798 1/20 0.34

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
SCHEMBL5445053 0.89 HPRT1 (0.50) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL4110292 0.84 ALDH1A1 (0.36) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL4722326 0.84 ALDH1A1 (0.36) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL8733681 0.83 ALDH1A1 (0.35) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL23803187 0.81 HPRT1 (0.45) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL291172 0.81 ALDH1A1 (0.37) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL9375653 0.80 ALDH1A1 (0.37) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL20774242 0.79 HPRT1 (0.50) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL441871 0.78 ALDH1A1 (0.60) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL29962858 0.78 ALDH1A1 (0.60) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2

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 263 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11964943-B2 3,5-diarylidenyl-n-substituted-piperid-4-one-derived inhibitors of Stat3 pathway activity and uses thereof KIAKOS KONSTANTINOS (AT) 2024-04-23 US disclosed
EP-3223952-B1 ENERGY INPUT DURING AGGLOMERATION FOR MAGNETIC SEPARATION BASF SE (DE) 2024-01-17 EP disclosed
CN-110249064-B Use of copolymers as binders for pelletizing metal-containing ores 巴斯夫欧洲公司 2022-01-28 CN disclosed
CN-108367300-B Ultrafiltration of magnetically responsive support particles 巴斯夫欧洲公司 2022-01-14 CN disclosed
EP-3344788-B1 USE OF HYDROPHOBICALLY ASSOCIATING COPOLYMERS AS BINDERS FOR PELLETIZING METAL CONTAINING ORES BASF SE (DE) 2021-12-15 EP disclosed
US-20200399220-A1 3,5-DIARYLIDENYL-N-SUBSTITUTED-PIPERID-4-ONE-DERIVED INHIBITORS OF STAT3 PATHWAY ACTIVITY AND USES THEREOF KIAKOS KONSTANTINOS (AT) 2020-12-24 US disclosed
CN-107206392-B Improvement of concentrate quality 巴斯夫欧洲公司 2020-11-06 CN disclosed
WO-2019097080-A9 3,5-DIARYLIDENYL-N-SUBSTITUTED-PIPERID-4-ONE-DERIVED INHIBITORS OF STAT3 PATHWAY ACITIVTY AND USES THEROF KIAKOS KONSTANTINOS (AT) 2020-10-15 WO disclosed
EP-3713916-A1 3,5-DIARYLIDENYL-N-SUBSTITUTED-PIPERID-4-ONE-DERIVED INHIBITORS OF STAT3 PATHWAY ACITIVTY AND USES THEROF Kiakos, Konstantinos (AT) 2020-09-30 EP disclosed
EP-2880033-B1 CYCLIC UREA- OR LACTAM-SUBSTITUTED QUINOXALINE-TYPE PIPERIDINE COMPOUNDS AND THE USES THEREOF PURDUE PHARMA LP (US) 2020-06-17 EP disclosed
WO-2004058754-A1 BENZOAZOLYPIPERAZINE DERIVATIVES HAVING MGLUR1- AND MGLUR5-ANTAGONISTIC ACTIVITY EURO-CELTIQUE S.A. (LU) 2004-07-15 WO disclosed
US-20040127501-A1 Therapeutic agents useful for treating pain EURO-CELTIQUE S.A. (LU) 2004-07-01 US disclosed
US-20040106625-A1 cyanoiminopiperazines which inhibit vanilloid receptor 1 function in a cell PURDUE PHARMA L.P. 2004-06-03 US disclosed
WO-2004029031-A2 THERAPEUTIC PIPERAZINE COMPOUNDS EURO-CELTQUE, S.A. (LU) 2004-04-08 WO disclosed
WO-2004029044-A1 PYRIMIDINE COMPOUNDS AS THERAPEUTIC AGENTS EURO-CELTIQUE, S.A. (LU) 2004-04-08 WO disclosed
US-20040053914-A1 Therapeutic agents useful for treating pain PURDUE PHARMA L.P. 2004-03-18 US disclosed
WO-2004011441-A1 PYRIDAZINYLPIPERAZINE DERIVATIVES FOR TREATING PAIN EURO-CELTIQUE S.A. (LU) 2004-02-05 WO disclosed
WO-2004002983-A2 THERAPEUTIC PIPERAZINE DERIVATIVES USEFUL FOR TREATING PAIN EURO-CELTIQUE, S.A. (LU) 2004-01-08 WO disclosed
WO-2003093236-A1 1-(PYRID-2-YL)-PIPERAZINE COMPOUNDS AS METABOTROPIC GLUTAMATE RECEPTOR INHIBITOR EURO-CELTIQUE, S.A. (LU) 2003-11-13 WO disclosed
EP-0321918-A2 Process for the enzymatic racemate cleavage of racemic alcohols with/in vinyl esters by transesterification HOECHST AKTIENGESELLSCHAFT (DE) 1989-06-28 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 (5 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-20040053914-A1 Therapeutic agents useful for treating pain SMN1; SMN2, OPRM1, PSEN1 ALDH1A1 416/4885HSD17B10 2816/4885HIF1A 1087/4885
US-20040127501-A1 Therapeutic agents useful for treating pain CACNA1A, GRIN2A, HTT ALDH1A1 516/4885HSD17B10 2079/4885HIF1A 1463/4885
US-11964943-B2 3,5-diarylidenyl-n-substituted-piperid-4-one-derived inhibitors of Stat3 pathway activity and uses thereof STAT3, JAK2, STAT6 ALDH1A1 928/4885HSD17B10 4013/4885HIF1A 1346/4885
US-20040106625-A1 cyanoiminopiperazines which inhibit vanilloid receptor 1 function in a cell MC1R, MC5R, CHRNA5 ALDH1A1 987/4885HSD17B10 1220/4885HIF1A 1305/4885
US-20200399220-A1 3,5-DIARYLIDENYL-N-SUBSTITUTED-PIPERID-4-ONE-DERIVED INHIBITORS OF STAT3 PATHWAY ACTIVITY AND USES THEREOF STAT3, JAK2, STAT6 ALDH1A1 928/4885HSD17B10 4013/4885HIF1A 1346/4885

“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.