SCHEMBL96304

SCHEMBL96304

CC([O])C(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
PGR P06401 1/20 0.53
ADRA2A P08913 1/20 0.53
ADRA2B P18089 1/20 0.53
HTR2A P28223 1/20 0.53
HRH1 P35367 1/20 0.53
KCNH2 Q12809 1/20 0.53
LMNA P02545 4/20 0.52
CES2 O00748 4/20 0.52
CES1 P23141 4/20 0.52
SMN1; SMN2 Q16637 3/20 0.48
MAPT P10636 3/20 0.48
NPSR1 Q6W5P4 2/20 0.48
ATM Q13315 2/20 0.48
MDM2 Q00987 1/20 0.48
XBP1 P17861 1/20 0.48
ALDH1A1 P00352 3/20 0.48
TSHR P16473 3/20 0.48
DAO P14920 1/20 0.48

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
SCHEMBL187606 0.83 TDP1 (0.52) TDP1L3MBTL1PGRADRA2AADRA2B
SCHEMBL19695429 0.83 TDP1 (0.52) TDP1L3MBTL1PGRADRA2AADRA2B
SCHEMBL1397470 0.82 KMT2A (0.58) TDP1L3MBTL1PGRADRA2AADRA2B
SCHEMBL28283115 0.82 TDP1 (0.56) TDP1L3MBTL1PGRADRA2AADRA2B
SCHEMBL163939 0.82 TDP1 (0.56) TDP1L3MBTL1PGRADRA2AADRA2B
SCHEMBL13039632 0.82 LMNA (0.56) TDP1L3MBTL1PGRADRA2AADRA2B
SCHEMBL15834920 0.80 LMNA (0.55) TDP1L3MBTL1PGRADRA2AADRA2B
SCHEMBL12251084 0.80 LMNA (0.55) TDP1L3MBTL1PGRADRA2AADRA2B
SCHEMBL1093883 0.80 LMNA (0.58) TDP1L3MBTL1PGRADRA2AADRA2B
Bromide SCHEMBL8414921 0.80 TDP1 (0.54) TDP1L3MBTL1PGRADRA2AADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0123441-B1 VINCALEUKOBLASTINE DERIVATIVES LILLY INDUSTRIES LIMITED (GB) 1990-10-03 EP claimed
US-4675400-A FORM CONJUGATES WITH IMMUNOGLOBULINS; ANTITUMOR AGENTS ELI LILLY AND COMPANY (US) 1987-06-23 US claimed
US-4596676-A Bifunctional ester derivatives of 4-desacetyl indole-dihydroindole alkaloids LILLY INDUSTRIES LIMITED (GB) 1986-06-24 US claimed
EP-0123441-A1 Vincaleukoblastine derivatives LILLY INDUSTRIES LIMITED (GB) 1984-10-31 EP claimed
WO-2023234187-A1 METHOD FOR PRODUCING ORGANIC COPPER COMPOUND シンクレスト株式会社 2023-12-07 WO disclosed
US-9981008-B2 Apolipoprotein A-I mimics CERENIS THERAPEUTICS HOLDING SA (FR) 2018-05-29 US disclosed
EP-2939683-B1 Apolipoprotein A-I Mimics CERENIS THERAPEUTICS HOLDING SA (FR) 2017-01-04 EP disclosed
US-20160324923-A1 APOLIPOPROTEIN A-I MIMICS CERENIS THERAPEUTICS HOLDING SA (FR) 2016-11-10 US disclosed
US-9388232-B2 Apolipoprotein A-I mimics CERENIS THERAPEUTICS HOLDING SA (FR) 2016-07-12 US disclosed
EP-2939683-A1 Apolipoprotein A-I Mimics Cerenis Therapeutics Holding SA (FR) 2015-11-04 EP disclosed
EP-2396017-B1 APOLIPOPROTEIN A-I MIMICS CERENIS THERAPEUTICS HOLDING SA (FR) 2015-07-01 EP disclosed
US-20150141330-A1 APOLIPOPROTEIN A-I MIMICS CERENIS THERAPEUTICS HOLDING SA (FR) 2015-05-21 US disclosed
US-4533730-A BACTERICIDES SHIONOGI & CO., LTD. (JP) 1985-08-06 US disclosed
US-4504659-A 1-Oxadethiacepham compounds SHIONOGI & CO., LTD. (JP) 1985-03-12 US disclosed
EP-0123441-A1 Vincaleukoblastine derivatives LILLY INDUSTRIES LIMITED (GB) 1984-10-31 EP disclosed
US-4478997-A 1-Oxadethiacepham compounds SHIONOGI & CO., LTD. (JP) 1984-10-23 US disclosed
US-4443598-A ANTIBIOTICS AND INTERMEDIATES SHIONOGI & CO., LTD. (JP) 1984-04-17 US disclosed
US-4439229-A Substituted phthalimides herbicides ROHM AND HAAS COMPANY (US) 1984-03-27 US disclosed
EP-0068822-A2 Novel heterocyclic substituted benzenes, herbicidal compositions containing them and the use thereof for combating weeds ROHM AND HAAS COMPANY (US) 1983-01-05 EP disclosed
US-4366316-A FROM OXAZOLINOAZETIDINONE AND ACID SHIONOGI & CO., LTD. (JP) 1982-12-28 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 (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-20160324923-A1 APOLIPOPROTEIN A-I MIMICS APOB, APOL1, LIPG TDP1 1451/4885L3MBTL1 992/4885PGR 2597/4885
US-20150141330-A1 APOLIPOPROTEIN A-I MIMICS APOB, APOL1, LIPG TDP1 1451/4885L3MBTL1 992/4885PGR 2597/4885

“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.