SCHEMBL433486

SCHEMBL433486

CCCCC(=O)CC(=O)c1ccc(O)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 8/20 0.73
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
ESR1 P03372 4/20 0.51
HTR7 P34969 1/20 0.51
ESR2 Q92731 1/20 0.51
TSHR P16473 2/20 0.49
LMNA P02545 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2D6 P10635 1/20 0.49
MAPK1 P28482 1/20 0.49
CYP2C19 P33261 1/20 0.49
NR1H2 P55055 1/20 0.49
RNASEL Q05823 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ALDH1A1 P00352 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ABL1 P00519 1/20 0.48
POLB P06746 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
SCHEMBL22207545 0.93 HSD17B3 (0.75) HSD17B3NPC1RAB9AESR1ESR2
SCHEMBL9483582 0.85 HSD17B3 (0.62) HSD17B3HTR7
SCHEMBL420677 0.85 HSD17B3 (1.00) HSD17B3NPC1RAB9AESR1HTR7
SCHEMBL28294449 0.84 HTR7 (0.74) HSD17B3NPC1RAB9AHTR7SMN1; SMN2
SCHEMBL6602564 0.84 CES1 (0.58) HSD17B3NPC1RAB9AHTR7LMNA
SCHEMBL13882426 0.83 HSD17B3 (0.69) HSD17B3NPC1RAB9AESR1HTR7
SCHEMBL12075203 0.83 HSD17B3 (0.59) HSD17B3NPC1RAB9AESR1HTR7
SCHEMBL11137804 0.81 NPC1 (0.50) HSD17B3NPC1RAB9AHTR7LMNA
SCHEMBL585367 0.81 HDAC1 (0.57) NPC1RAB9ALMNAMAPK1ALDH1A1
SCHEMBL18286487 0.81 MMP1 (0.64) NPC1TSHRLMNACYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2636670-B1 Process for preparing benzofurans CAMBREX KARLSKOGA AB (SE) 2016-06-01 EP disclosed
EP-2636670-B1 Process for preparing benzofurans CAMBREX KARLSKOGA AB (SE) 2016-06-01 EP disclosed
CN-103342633-B For the preparation of the method for benzofuran compounds CAMBREX KARLSKOGA AB (SE) 2016-05-04 CN disclosed
EP-2417099-B1 NEW PROCESS FOR PREPARING HYDROXYLAMINES AND MEDICAMENTS CAMBREX KARLSKOGA AB (SE) 2015-12-23 EP disclosed
EP-2417099-B1 NEW PROCESS FOR PREPARING HYDROXYLAMINES AND MEDICAMENTS CAMBREX KARLSKOGA AB (SE) 2015-12-23 EP disclosed
CN-102459154-B For the preparation of the novel method of azanol class and medicine CAMBREX KARLSKOGA AB (SE) 2015-12-02 CN disclosed
EP-2388256-B1 Process for preparing benzofurans CAMBREX KARLSKOGA AB (SE) 2015-11-25 EP disclosed
EP-2388256-B1 Process for preparing benzofurans CAMBREX KARLSKOGA AB (SE) 2015-11-25 EP disclosed
CN-102171200-B For the preparation of the method for diones and medicine CAMBREX KARLSKOGA AB (SE) 2015-09-30 CN disclosed
US-20140206761-A1 PROCESS FOR PREPARING HYDROXYLAMINES AND MEDICAMENTS CAMBREX KARLSKOGA AB (SE) 2014-07-24 US disclosed
US-20100292319-A1 PROCESS FOR PREPARING BENZOFURANS CAMBREX KARLSKOGA AB (SE) 2010-11-18 US disclosed
US-20100292319-A1 PROCESS FOR PREPARING BENZOFURANS CAMBREX KARLSKOGA AB (SE) 2010-11-18 US disclosed
US-20100292319-A1 PROCESS FOR PREPARING BENZOFURANS CAMBREX KARLSKOGA AB (SE) 2010-11-18 US disclosed
EP-2246341-A1 Process for preparing 2-Alkyl-3-aroyl-5-nitro-benzofurans Lonza Ltd. (CH) 2010-11-03 EP disclosed
WO-2010116140-A1 NEW PROCESS FOR PREPARING HYDROXYLAMINES AND MEDICAMENTS CAMBREX KARLSKOGA AB (SE) 2010-10-14 WO disclosed
EP-2200993-A2 PROCESS FOR PREPARING BENZOFURANS Cambrex Karlskoga AB (SE) 2010-06-30 EP disclosed
WO-2010040261-A1 PROCESS FOR PREPARING 2-ALKYL-3-AROYL-5-NITRO-BENZOFURANS LONZA LTD (CH) 2010-04-15 WO disclosed
WO-2010038029-A1 NEW PROCESS FOR PREPARING DIKETONES AND MEDICAMENTS CAMBREX KARLSKOGA AB (SE) 2010-04-08 WO disclosed
WO-2010038029-A1 NEW PROCESS FOR PREPARING DIKETONES AND MEDICAMENTS CAMBREX KARLSKOGA AB (SE) 2010-04-08 WO disclosed
WO-2009044143-A2 PROCESS FOR PREPARING BENZOFURANS CAMBREX KARLSKOGA AB (SE) 2009-04-09 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-20140206761-A1 PROCESS FOR PREPARING HYDROXYLAMINES AND MEDICAMENTS CYP3A4, CYP1A2, CYP2D6 HSD17B3 452/4885NPC1 1204/4885RAB9A 1617/4885
US-20100292319-A1 PROCESS FOR PREPARING BENZOFURANS CYP2F1, CYP3A4, CYP4F3 HSD17B3 453/4885NPC1 905/4885RAB9A 602/4885

“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.