SCHEMBL3869264

SCHEMBL3869264

O=C(O)c1ccc2ccccc2[n+]1[O-]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
MEN1 O00255 6/20 0.37
KMT2A Q03164 6/20 0.37
ALDH1A1 P00352 5/20 0.37
MGAM O43451 1/20 0.36
WDR5 P61964 1/20 0.36
LDHA P00338 1/20 0.35
KDM4E B2RXH2 4/20 0.35
HPGD P15428 2/20 0.35
APOBEC3A P31941 2/20 0.35
APOBEC3G Q9HC16 2/20 0.35
NR4A1 P22736 1/20 0.34
NR4A2 P43354 1/20 0.34
NR4A3 Q92570 1/20 0.34
CYP1A2 P05177 1/20 0.34
GLA P06280 1/20 0.34
CYP2C19 P33261 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL29794225 1.00 ATM (0.47) ATMNPC1RAB9AMEN1KMT2A
SCHEMBL28345567 0.83 ATM (0.45) ATMNPC1RAB9AMEN1KMT2A
SCHEMBL30915437 0.79 ALDH1A1 (0.42) ATMNPC1RAB9AMEN1KMT2A
SCHEMBL1680562 0.79 ALDH1A1 (0.42) ATMNPC1RAB9AMEN1KMT2A
SCHEMBL10373161 0.74 CNR2 (0.54) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL6806663 0.73 LMNA (0.42) ATMRAB9AMEN1KMT2AALDH1A1
SCHEMBL28150148 0.73 MEN1 (0.40) ATMNPC1RAB9AMEN1KMT2A
SCHEMBL4145326 0.71 ATM (0.54) ATMNPC1RAB9AMEN1KMT2A
SCHEMBL538204 0.71 TSHR (0.51) ALDH1A1KDM4ECYP1A2CYP2C19HSD17B10
SCHEMBL8456760 0.70 ATM (0.53) ATMMEN1KMT2AALDH1A1WDR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117447847-B Wear-resistant rubber composite material and preparation method thereof 河北能一重型机械配件有限公司 2024-02-23 CN claimed
CN-117447847-A Wear-resistant rubber composite material and preparation method thereof 河北能一重型机械配件有限公司 2024-01-26 CN claimed
CN-101899003-A Quinoline derivative-N-oxide ligand as well as preparation method and application thereof SHANGHAI INST TECHNOLOGY 2010-12-01 CN claimed
EP-0090173-B1 METHOD FOR THE PREPARATION OF 2-AMINOPYRIDINS STARTING FROM N-OXIDES OF 2-PYRIDINE-CARBONIC ACIDS LONZA AG (CH) 1986-08-20 EP claimed
CN-117447847-B Wear-resistant rubber composite material and preparation method thereof 河北能一重型机械配件有限公司 2024-02-23 CN disclosed
CN-117447847-A Wear-resistant rubber composite material and preparation method thereof 河北能一重型机械配件有限公司 2024-01-26 CN disclosed
CN-101899003-A Quinoline derivative-N-oxide ligand as well as preparation method and application thereof SHANGHAI INST TECHNOLOGY 2010-12-01 CN disclosed
US-7601686-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-10-13 US disclosed
US-7601686-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-10-13 US disclosed
WO-2007008657-A2 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-18 WO disclosed
US-20070010455-A1 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-01-11 US disclosed
US-20070010455-A1 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-01-11 US disclosed
EP-0746561-B1 QUINOLONYLCARBOXAMIDOCEPHALOSPORIN DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ARANDA LAB SA DE CV (MX) 1999-04-28 EP disclosed
US-5728691-A Quinolonylcarboxamidocephalosporin derivatives and pharmaceutical compositions containing them LABORATORIOS ARANDA S.A. DE C.V. (MX) 1998-03-17 US disclosed
EP-0746561-A1 QUINOLONYLCARBOXAMIDOCEPHALOSPORIN DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM LABORATORIOS ARANDA, S.A. DE C.V. (MX/MX) (MX) 1996-12-11 EP disclosed
WO-1995023153-A1 QUINOLONYLCARBOXAMIDOCEPHALOSPORIN DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM LABORATORIOS ARANDA, S.A. DE C.V. (MX) 1995-08-31 WO disclosed
US-4414416-A Certain diacetyl-amino-phenolic derivatives FISONS LIMITED (GB) 1983-11-08 US disclosed
US-4328341-A Process for preparing certain pyrano[3,2-g]quinoline 2,8-dicarboxylates and 4-oxo-quinoline-2-carboxylates FISONS LIMITED (GB) 1982-05-04 US disclosed
EP-0030423-A1 A process for the production of 1,4-dihydro-4-oxo-quinoline-2-carboxylic acids, or salts, esters or amides thereof and intermediates therefor FISONS plc (GB) 1981-06-17 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-20070010455-A1 Hepatitis C virus inhibitors HAVCR2, VIP, ENPEP ATM 4247/4885NPC1 485/4885RAB9A 3149/4885

“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.