SCHEMBL6711020

SCHEMBL6711020

CCOC(=O)C(=CNc1ccccc1)C(=O)c1cc(CN2CCOCC2)ccc1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
RAB9A P51151 6/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
NPC1 O15118 4/20 0.47
TP53 P04637 2/20 0.47
DHODH Q02127 2/20 0.45
NPSR1 Q6W5P4 2/20 0.44
KDM4E B2RXH2 1/20 0.44
POLB P06746 1/20 0.44
HIF1A Q16665 1/20 0.43
EPAS1 Q99814 1/20 0.43
MAPT P10636 2/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
STAT3 P40763 1/20 0.43
ALDH1A1 P00352 2/20 0.42
CNR2 P34972 1/20 0.41
HTT P42858 1/20 0.40
ACHE P22303 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL6711016 1.00 LMNA (0.48) LMNARAB9ASMN1; SMN2NPC1TP53
SCHEMBL6710843 0.92 SMN1; SMN2 (0.46) LMNARAB9ASMN1; SMN2NPC1TP53
SCHEMBL6709470 0.92 SMN1; SMN2 (0.46) LMNARAB9ASMN1; SMN2NPC1TP53
SCHEMBL6709491 0.91 LMNA (0.43) LMNARAB9ASMN1; SMN2NPC1TP53
SCHEMBL6709495 0.91 LMNA (0.43) LMNARAB9ASMN1; SMN2NPC1TP53
SCHEMBL6709485 0.91 NPSR1 (0.47) LMNARAB9ASMN1; SMN2NPC1TP53
SCHEMBL6709489 0.91 NPSR1 (0.47) LMNARAB9ASMN1; SMN2NPC1TP53
SCHEMBL6709488 0.91 ALDH1A1 (0.46) LMNARAB9ASMN1; SMN2NPC1TP53
SCHEMBL6709484 0.91 ALDH1A1 (0.46) LMNARAB9ASMN1; SMN2NPC1TP53
SCHEMBL6709569 0.91 LMNA (0.42) LMNARAB9ASMN1; SMN2NPC1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040024209-A1 1-Aryl-4-oxo-1,4-dihydro-3-quinolinecarboxamides as antiviral agents SCHNUTE MARK E (US) 2004-02-05 US disclosed
US-6653307-B2 Such as N-(4-chlorobenzyl)-6-(4-morpholinylmethyl)-4-oxo-1-phenyl-1,4-dihydro-3-quinolinecarboxamide for treatment of herpes virus; viral DNA polymerase inhibitors PHARMACIA & UPJOHN COMPANY 2003-11-25 US disclosed
EP-1292575-A2 1-ARYL-4-OXO-1,4-DIHYDRO-3-QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2003-03-19 EP disclosed
US-20020103220-A1 1-Aryl-4oxo-1,4-Dihydro-3-quinolinecarboxamides as antiviral agents PHARMACIA & UPJOHN COMPANY 2002-08-01 US disclosed
WO-2001098275-A2 1-ARYL-4-OXO-1,4-DIHYDRO-3-QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2001-12-27 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-20040024209-A1 1-Aryl-4-oxo-1,4-dihydro-3-quinolinecarboxamides as antiviral agents ZC3HAV1, ZC3HAV1L, IRF3 LMNA 4117/4885RAB9A 2067/4885SMN1; SMN2 4052/4885
US-20020103220-A1 1-Aryl-4oxo-1,4-Dihydro-3-quinolinecarboxamides as antiviral agents ZC3HAV1, IRF3, ZC3HAV1L LMNA 4241/4885RAB9A 2302/4885SMN1; SMN2 4347/4885

“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.