SCHEMBL4331415

SCHEMBL4331415

C=CCOc1ccc(C(=O)c2ccccc2)cc1OCC=C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.55
ELANE P08246 3/20 0.51
LMNA P02545 3/20 0.49
ALDH1A1 P00352 3/20 0.48
PDE4B Q07343 1/20 0.48
GAA P10253 2/20 0.48
TSHR P16473 1/20 0.48
HPGD P15428 2/20 0.48
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
ATM Q13315 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
LIG1 P18858 1/20 0.46
MAPT P10636 1/20 0.43
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43

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
SCHEMBL12710862 0.88 KDM4E (0.47) KDM4EELANELMNAALDH1A1PDE4B
SCHEMBL15312851 0.84 KDM4E (0.60) KDM4EALDH1A1PDE4BGAATSHR
SCHEMBL2972344 0.81 GAA (0.60) ELANELMNAALDH1A1GAAHPGD
SCHEMBL23748267 0.80 ALDH1A1 (0.58) KDM4ELMNAALDH1A1GAAATM
SCHEMBL22229873 0.80 KDM4E (0.62) KDM4ELMNAALDH1A1PDE4BGAA
SCHEMBL9130664 0.80 KDM4E (0.58) KDM4ELMNAALDH1A1PDE4BGAA
SCHEMBL16090170 0.80 PTGDR2 (0.60) LMNAALDH1A1HPGDCYP1A2CYP2D6
SCHEMBL13690626 0.78 KDM4E (0.57) KDM4EALDH1A1PDE4BGAATSHR
SCHEMBL132849 0.78 LIG1 (0.63) KDM4EELANEGAATSHRHPGD
SCHEMBL23748273 0.77 LIG1 (0.51) KDM4EALDH1A1GAATSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11773207-B2 Thiol compound, method for synthesizing same, and uses for said thiol compound SHIKOKU CHEMICALS CORPORATION (JP) 2023-10-03 US disclosed
US-11773207-B2 Thiol compound, method for synthesizing same, and uses for said thiol compound SHIKOKU CHEMICALS CORPORATION (JP) 2023-10-03 US disclosed
WO-2020145111-A1 THIOL COMPOUND, METHOD FOR SYNTHESIZING SAME, AND USES FOR SAID THIOL COMPOUND 四国化成工業株式会社 2020-07-16 WO disclosed
US-7592143-B2 Methods of treating diseases responsive to induction of apoptosis and screening assays CYTOVIA, INC. (US) 2009-09-22 US disclosed
EP-1620564-A4 METHODS OF TREATING DISEASES RESPONSIVE TO INDUCTION OF APOPTOSIS AND SCREENING ASSAYS CYTOVIA INC (US) 2008-03-12 EP disclosed
EP-1620564-A2 METHODS OF TREATING DISEASES RESPONSIVE TO INDUCTION OF APOPTOSIS AND SCREENING ASSAYS Cytovia, Inc. (US) 2006-02-01 EP disclosed
US-20050004026-A1 Methods of treating diseases responsive to induction of Apoptosis and screening assays CYTOVIA, INC. 2005-01-06 US disclosed
WO-2004094647-A2 METHODS OF TREATING DISEASES RESPONSIVE TO INDUCTION OF APOPTOSIS AND SCREENING ASSAYS CYTOVIA, INC. (US) 2004-11-04 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 (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-20050004026-A1 Methods of treating diseases responsive to induction of Apoptosis and screening assays HEATR6, HEATR1, AIP KDM4E 4490/4885ELANE 4448/4885LMNA 4586/4885
US-11773207-B2 Thiol compound, method for synthesizing same, and uses for said thiol compound TST, TMT1A, CTH KDM4E 1377/4885ELANE 748/4885LMNA 4474/4885

“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.