SCHEMBL87570

SCHEMBL87570

O=C1C=Cc2ccc3cc4cc5ccccc5cc4cc3c2C1=O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 6/20 0.70
ALDH1A1 P00352 5/20 0.39
HSD17B10 Q99714 3/20 0.39
PTPRC P08575 3/20 0.39
MEN1 O00255 2/20 0.39
LMNA P02545 2/20 0.39
HPGD P15428 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 2/20 0.39
ALOX15 P16050 2/20 0.39
BCHE P06276 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
PKM P14618 1/20 0.39
IDO1 P14902 1/20 0.39
PTPN1 P18031 1/20 0.39
ACHE P22303 1/20 0.39
RECQL P46063 1/20 0.39
PTPN22 Q9Y2R2 1/20 0.39

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
SCHEMBL7213583 0.98 CES1 (0.72) CES1ALDH1A1HSD17B10PTPRCMEN1
SCHEMBL380656 0.82 CES1 (1.00) CES1ALDH1A1HSD17B10PTPRCMEN1
SCHEMBL29460197 0.78 CES1 (0.83) CES1ALDH1A1HSD17B10PTPRCMEN1
SCHEMBL2995536 0.75 CES1 (0.54) CES1ALDH1A1HSD17B10PTPRCMEN1
SCHEMBL22609991 0.74 CES1 (0.81) CES1ALDH1A1HSD17B10PTPRCMEN1
Furan SCHEMBL3095660 0.74 CES1 (0.81) CES1ALDH1A1HSD17B10PTPRCMEN1
SCHEMBL29447251 0.74 ALDH1A1 (0.64) CES1ALDH1A1HSD17B10MEN1LMNA
SCHEMBL2957612 0.74 ALDH1A1 (0.64) CES1ALDH1A1HSD17B10MEN1LMNA
Anthracene SCHEMBL28233789 0.72 CES1 (0.39) CES1ALDH1A1HSD17B10MEN1HPGD
SCHEMBL146910 0.72 PTPRC (0.53) CES1ALDH1A1HSD17B10PTPRCMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0940144-A1 BIOACTIVE POLYMER PRODUCT EBARA CORPORATION (JP) 1999-09-08 EP claimed
WO-1998011230-A1 POLYKETIDE SYNTHASES FOR PRADIMICIN BIOSYNTHESIS AND DNA SEQUENCES ENCODING SAME BRISTOL-MYERS SQUIBB COMPANY (US) 1998-03-19 WO claimed
EP-3383405-B1 ANTIBIOTIC FIIRV 104/18 COMPLEX AND THE ISOLATED INDIVIDUAL FACTORS THEREOF FONDAZIONE ST INSUBRICO DI RICERCA PER LA VITA (IT) 2024-06-12 EP disclosed
EP-3601246-B1 16-METHYL-OXACYCLOHEXADECAN-2-ONE AND 16-METHYL-AZACYCLOHEXADECAN-2-ONE DERIVATIVES AS ANTIMICROBIAL AGENTS THE UNIV OF MONTANA (US) 2023-06-07 EP disclosed
EP-3601246-A1 16-METHYL-OXACYCLOHEXADECAN-2-ONE AND 16-METHYL-AZACYCLOHEXADECAN-2-ONE DERIVATIVES AS ANTIMICROBIAL AGENTS The University Of Montana (US) 2020-02-05 EP disclosed
US-20190002942-A1 ANTIBIOTIC FIIRV 104/18 COMPLEX AND THE ISOLATED INDIVIDUAL FACTORS THEREOF FONDAZIONE ISTITUTO INSUBRICO DI RICERCA PER LA VITA (IT) 2019-01-03 US disclosed
EP-3383405-A1 ANTIBIOTIC FIIRV 104/18 COMPLEX AND THE ISOLATED INDIVIDUAL FACTORS THEREOF Fondazione Istituto Insubrico di Ricerca per la Vita (IT) 2018-10-10 EP disclosed
WO-2018175418-A1 16-METHYL-OXACYCLOHEXADECAN-2-ONE AND 16-METHYL-AZACYCLOHEXADECAN-2-ONE DERIVATIVES AS ANTIMICROBIAL AGENTS THE UNIVERSITY OF MONTANA (US) 2018-09-27 WO disclosed
WO-2017093114-A1 ANTIBIOTIC FIIRV 104/18 COMPLEX AND THE ISOLATED INDIVIDUAL FACTORS THEREOF FONDAZIONE ISTITUTO INSUBRICO DI RICERCA PER LA VITA (IT) 2017-06-08 WO disclosed
EP-2500437-B1 Methods for identifying compounds that modulate untranslated region-dependent gene expression and methods of using same PTC THERAPEUTICS INC (US) 2016-11-30 EP disclosed
US-9493845-B2 Methods for identifying compounds that modulate untranslated region-dependent gene expression and methods of using same PTC THERAPEUTICS, INC. (US) 2016-11-15 US disclosed
EP-0937082-A2 MATERIALS AND METHOD FOR TREATING OR PREVENTING PATHOGENIC FUNGAL INFECTION ARIAD PHARMACEUTICALS, INC. (US) 1999-08-25 EP disclosed
WO-1998011230-A1 POLYKETIDE SYNTHASES FOR PRADIMICIN BIOSYNTHESIS AND DNA SEQUENCES ENCODING SAME BRISTOL-MYERS SQUIBB COMPANY (US) 1998-03-19 WO disclosed
WO-1998002441-A2 NON IMMUNOSUPPRESSIVE ANTIFUNGAL RAPALOGS ARIAD PHARMACEUTICALS, INC. (US) 1998-01-22 WO disclosed
EP-0684253-A1 DESALANINEBENANOMICIN A DERIVATIVE AND PRODUCTION THEREOF ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1995-11-29 EP disclosed
US-5110960-A Tetracycline, anthracycline and anthraquinone antibiotics BRISTOL-MYERS COMPANY (US) 1992-05-05 US disclosed
EP-0277621-B1 ANTIFUNGAL ANTIBIOTICS Bristol-Myers Squibb Company (US) 1992-02-05 EP disclosed
US-4990497-A Antifungal antibiotics OKI TOSHIKAZU (JP) 1991-02-05 US disclosed
US-4870165-A TETRACYCLINE-TYPE BRISTOL-MYERS COMPANY (US) 1989-09-26 US disclosed
EP-0277621-A1 Antifungal antibiotics Bristol-Myers Squibb Company (US) 1988-08-10 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 (1 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-20190002942-A1 ANTIBIOTIC FIIRV 104/18 COMPLEX AND THE ISOLATED INDIVIDUAL FACTORS THEREOF MRPL38, F5, F8 CES1 4354/4885ALDH1A1 4070/4885HSD17B10 836/4885

“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.