SCHEMBL7684585

SCHEMBL7684585

O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1ccc2cccnc2c1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
NPC1 O15118 2/20 0.56
HTT P42858 2/20 0.56
KDR P35968 3/20 0.55
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
ALDH1A1 P00352 2/20 0.55
TP53 P04637 2/20 0.55
AURKA O14965 1/20 0.55
PDPK1 O15530 1/20 0.55
JAK2 O60674 1/20 0.55
GMNN O75496 1/20 0.55
EGFR P00533 1/20 0.55
LMNA P02545 1/20 0.55
CYP1A2 P05177 1/20 0.55
LYN P07948 1/20 0.55
CHRM2 P08172 1/20 0.55
CYP3A4 P08684 1/20 0.55
ADRA2A P08913 1/20 0.55

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
SCHEMBL7692718 0.87 KCNMA1 (0.59) RAB9ASMN1; SMN2NPC1HTTKDR
SCHEMBL7691461 0.85 EGLN1 (0.56) RAB9ASMN1; SMN2NPC1HTTKDR
SCHEMBL7688593 0.85 EGLN1 (0.61) RAB9ANPC1KDRMEN1KMT2A
SCHEMBL7691504 0.83 L3MBTL1 (0.60) KDRMEN1KMT2AALDH1A1MAPT
SCHEMBL29617471 0.83 MEN1 (0.67) RAB9ASMN1; SMN2NPC1HTTKDR
SCHEMBL3243499 0.83 MEN1 (0.67) RAB9ASMN1; SMN2NPC1HTTKDR
SCHEMBL7683260 0.82 EGLN1 (0.71) RAB9ASMN1; SMN2NPC1KDRMEN1
SCHEMBL7690027 0.81 EGLN1 (0.66) RAB9ASMN1; SMN2NPC1HTTKDR
SCHEMBL7684545 0.81 EGLN1 (0.68) SMN1; SMN2KDRMEN1KMT2AALDH1A1
SCHEMBL7686835 0.80 EGLN1 (0.69) KDRMEN1KMT2AALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6500842-B1 N-((4-CHLOROPHENYL)METHYL)-8-HYDROXY-7-QUINOLINECARBOXAMIDE ADMINISTERED AS VIRICIDES AGAINST HERPES VIRUS PHARMACIA & UPJOHN COMPANY 2002-12-31 US claimed
US-6310211-B1 ANTI-VIRAL ACTIVITY AGAINST HERPES VIRUS, CYTOMEGALOVIRUS. MANY OF THESE COMPOUNDS ARE ALSO ACTIVE AGAINST VARICELLA ZOSTER VIRUS, EPSTEIN-BARR VIRUS, HERPES SIMPLEX VIRUS AND HUMAN HERPES VIRUS TYPE 8 PHARMACIA & UPJOHN COMPANY 2001-10-30 US claimed
EP-0927164-A1 8-HYDROXY-7-SUBSTITUTED QUINOLINES AS ANTI-VIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 1999-07-07 EP claimed
WO-1998011073-A1 8-HYDROXY-7-SUBSTITUTED QUINOLINES AS ANTI-VIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 1998-03-19 WO claimed
US-20210205292-A1 INHIBITORS OF CREB-CBP INTERACTION FOR TREATMENT OF LEUKEMIA THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2021-07-08 US disclosed
WO-2017156489-A1 INHIBITORS OF CREB-CBP INTERACTION FOR TREATMENT OF LEUKEMIA THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2017-09-14 WO disclosed
US-6500842-B1 N-((4-CHLOROPHENYL)METHYL)-8-HYDROXY-7-QUINOLINECARBOXAMIDE ADMINISTERED AS VIRICIDES AGAINST HERPES VIRUS PHARMACIA & UPJOHN COMPANY 2002-12-31 US disclosed
US-6310211-B1 ANTI-VIRAL ACTIVITY AGAINST HERPES VIRUS, CYTOMEGALOVIRUS. MANY OF THESE COMPOUNDS ARE ALSO ACTIVE AGAINST VARICELLA ZOSTER VIRUS, EPSTEIN-BARR VIRUS, HERPES SIMPLEX VIRUS AND HUMAN HERPES VIRUS TYPE 8 PHARMACIA & UPJOHN COMPANY 2001-10-30 US disclosed
US-6252080-B1 HERPES, CYTOMEGALO VIRUS PHARMACIA & UPJOHN COMPANY 2001-06-26 US disclosed
US-6211376-B1 HERPES VIRUS, CYTOMEGALO VIRUS, VARICELLA-ZOSTER VIRUS,EPSTEIN-BARR VIRUS PHARMACIA & UPJOHN COMPANY 2001-04-03 US disclosed
EP-0927164-A1 8-HYDROXY-7-SUBSTITUTED QUINOLINES AS ANTI-VIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 1999-07-07 EP disclosed
WO-1998011073-A1 8-HYDROXY-7-SUBSTITUTED QUINOLINES AS ANTI-VIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 1998-03-19 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 (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-20210205292-A1 INHIBITORS OF CREB-CBP INTERACTION FOR TREATMENT OF LEUKEMIA CREBBP, CREB1, EP300 RAB9A 4564/4885SMN1; SMN2 3816/4885NPC1 4035/4885

“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.