SCHEMBL7537239

SCHEMBL7537239

O=[N+]([O-])c1ccc(OCc2ccccn2)nc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.54
GABRA5 P31644 1/20 0.51
KDM4E B2RXH2 1/20 0.50
MGMT P16455 1/20 0.48
LMNA P02545 2/20 0.48
HSPB1 P04792 2/20 0.46
KMT2A Q03164 4/20 0.45
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
TLR4 O00206 1/20 0.44
TLR2 O60603 1/20 0.44
HTR2C P28335 2/20 0.44
ALDH1A1 P00352 2/20 0.43
GAA P10253 1/20 0.43
APOBEC3A P31941 1/20 0.43
HTT P42858 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43
MAPT P10636 1/20 0.42

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
SCHEMBL30716904 1.00 POLB (0.54) POLBGABRA5KDM4EMGMTLMNA
Nicotinyl Alcohol SCHEMBL27089569 0.86 CYP19A1 (0.45) POLBGABRA5KDM4EMGMTKMT2A
SCHEMBL6500018 0.86 POLB (0.58) POLBGABRA5KDM4ELMNAHSPB1
SCHEMBL6787331 0.85 POLB (0.57) POLBGABRA5KDM4ELMNAHSPB1
SCHEMBL8128634 0.83 GAA (0.46) POLBGABRA5KDM4ELMNAHSPB1
SCHEMBL31504344 0.81 LMNA (0.72) POLBKDM4EMGMTLMNAKMT2A
SCHEMBL3570088 0.81 LMNA (0.72) POLBKDM4EMGMTLMNAKMT2A
SCHEMBL29562227 0.81 GABRA5 (0.57) POLBGABRA5LMNAHSPB1KMT2A
SCHEMBL221576 0.81 GABRA5 (0.57) POLBGABRA5LMNAHSPB1KMT2A
SCHEMBL7544748 0.76 MGMT (0.50) POLBKDM4EMGMTLMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117412960-A Isoindolinone compounds and imaging agents for imaging huntingtin CHDI基金会股份有限公司 2024-01-16 CN disclosed
CN-1147485-C Indoline derivatives useful as 5-HT-2C receptor antagonists ʷ��˿�������ȳ�ķ���޹�˾ 2004-04-28 CN disclosed
US-20020035134-A1 Indoline derivatives useful as 5-HT-2C receptor antagonists SMITHKLINE BEECHAM P.L.C. 2002-03-21 US disclosed
US-6313145-B1 FOR THERAPY OF ANXIETY AND/OR DEPRESSION SMITHKLINE BEECHAM P.L.C. (GB) 2001-11-06 US disclosed
EP-0912556-B1 INDOLINE DERIVATIVES USEFUL AS 5-HT-2C RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 2000-10-04 EP disclosed
CN-1222152-A Indoline derivatives useful as 5-HT-2C receptor antagonists SMITHKLINE BEECHAM PLC (GB) 1999-07-07 CN disclosed
EP-0912556-A1 INDOLINE DERIVATIVES USEFUL AS 5-HT-2C RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1999-05-06 EP disclosed
WO-1997048700-A1 INDOLINE DERIVATIVES USEFUL AS 5-HT-2C RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1997-12-24 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-20020035134-A1 Indoline derivatives useful as 5-HT-2C receptor antagonists HTR2C, HTR1A, HTR1D POLB 4422/4885GABRA5 201/4885KDM4E 3262/4885

“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.