SCHEMBL3704844

SCHEMBL3704844

Cc1ccccc1C(=O)C[O]

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ERCC5 P28715 1/20 0.60
FEN1 P39748 1/20 0.60
CTNNB1 P35222 6/20 0.51
WNT3A P56704 6/20 0.51
HPGD P15428 2/20 0.47
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HTT P42858 1/20 0.44
TSHR P16473 2/20 0.43
MAPK1 P28482 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
SCHEMBL8053673 0.84 ERCC5 (0.58) ERCC5FEN1CTNNB1WNT3AHPGD
SCHEMBL15979740 0.84 CTNNB1 (0.68) ERCC5FEN1CTNNB1WNT3AHPGD
SCHEMBL8735550 0.84 ERCC5 (0.74) ERCC5FEN1CTNNB1WNT3AHPGD
SCHEMBL30089517 0.84 CTNNB1 (0.68) ERCC5FEN1CTNNB1WNT3AHPGD
SCHEMBL2773397 0.82 ERCC5 (0.60) ERCC5FEN1CTNNB1WNT3AHPGD
SCHEMBL29639746 0.82 ERCC5 (0.60) ERCC5FEN1CTNNB1WNT3AHPGD
SCHEMBL364889 0.82 ERCC5 (0.60) ERCC5FEN1CTNNB1WNT3AHPGD
SCHEMBL31901342 0.82 ERCC5 (0.60) ERCC5FEN1CTNNB1WNT3AHPGD
SCHEMBL168885 0.80 ERCC5 (0.58) ERCC5FEN1CTNNB1WNT3AHPGD
SCHEMBL9939391 0.80 ERCC5 (0.58) ERCC5FEN1CTNNB1WNT3AHPGD

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 22 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
EP-2396017-A1 APOLIPOPROTEIN A-I MIMICS Cerenis Therapeutics SA (FR) 2011-12-21 EP disclosed
WO-2010093918-A1 APOLIPOPROTEIN A-I MIMICS CERENIS THERAPEUTICS SA (FR) 2010-08-19 WO disclosed
EP-0686636-B1 TRICYCLIC BENZAZEPINE AND BENZOTHIAZEPINE DERIVATIVES MEIJI SEIKA CO (JP) 2001-04-04 EP disclosed
US-5840895-A INTERMEDIATES FOR ANTIALLERGENS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1998-11-24 US disclosed
US-5686442-A ANTIALLERGENS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-11-11 US disclosed
EP-0686636-A1 TRICYCLIC BENZAZEPINE AND BENZOTHIAZEPINE DERIVATIVES MEIJI SEIKA KABUSHIKI KAISHA (JP) 1995-12-13 EP disclosed
EP-0123441-B1 VINCALEUKOBLASTINE DERIVATIVES LILLY INDUSTRIES LIMITED (GB) 1990-10-03 EP disclosed
US-4604460-A ANTIBIOTICS, BACTERICIDES SHIONOGI & CO., LTD. (JP) 1986-08-05 US disclosed
US-4596676-A Bifunctional ester derivatives of 4-desacetyl indole-dihydroindole alkaloids LILLY INDUSTRIES LIMITED (GB) 1986-06-24 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-4366316-A FROM OXAZOLINOAZETIDINONE AND ACID SHIONOGI & CO., LTD. (JP) 1982-12-28 US disclosed