SCHEMBL9190814

SCHEMBL9190814

O=C(Nc1ccc(Cl)cc1)Nc1cccnc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 1.00
MEN1 O00255 6/20 1.00
RAB9A P51151 5/20 1.00
NAMPT P43490 1/20 0.75
MAPT P10636 4/20 0.74
LMNA P02545 2/20 0.74
ALDH1A1 P00352 1/20 0.74
CNR1 P21554 2/20 0.72
NPC1 O15118 5/20 0.71
CYP11B1 P15538 1/20 0.69
CYP11B2 P19099 1/20 0.69
HTT P42858 2/20 0.69
TP53 P04637 1/20 0.69
KDM4E B2RXH2 2/20 0.66
GRIK1 P39086 1/20 0.64
PKM P14618 1/20 0.61

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
SCHEMBL8941244 0.90 MEN1 (0.82) KMT2AMEN1RAB9ANAMPTMAPT
SCHEMBL30051982 0.88 MEN1 (0.77) KMT2AMEN1RAB9ANAMPTMAPT
SCHEMBL9637653 0.88 MEN1 (0.77) KMT2AMEN1RAB9ANAMPTMAPT
SCHEMBL27308657 0.87 MEN1 (0.75) KMT2AMEN1RAB9ANAMPTMAPT
SCHEMBL10665495 0.86 RAB9A (0.79) KMT2AMEN1RAB9ANAMPTMAPT
SCHEMBL4911349 0.86 CNR1 (0.80) KMT2AMEN1RAB9ANAMPTMAPT
Hydrochloric Acid SCHEMBL29388210 0.86 MEN1 (0.74) KMT2AMEN1RAB9ANAMPTMAPT
Bromide SCHEMBL29417998 0.86 MEN1 (0.74) KMT2AMEN1RAB9ANAMPTMAPT
SCHEMBL30469259 0.84 CNR1 (1.00) KMT2AMEN1RAB9ACNR1
SCHEMBL20557904 0.84 CNR1 (1.00) KMT2AMEN1RAB9ACNR1

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
EP-0682656-A1 USE OF PHENYL HETEROARYL UREAS AS 5HT 2C? RECEPTOR ANTAGONISTS AND UREA COMPOUNDS SMITHKLINE BEECHAM PLC (GB) 1995-11-22 EP claimed
WO-1994018170-A1 USE OF PHENYL HETEROARYL UREAS AS 5HT2C RECEPTOR ANTAGONISTS AND UREA COMPOUNDS SMITHKLINE BEECHAM PLC (GB) 1994-08-18 WO claimed
US-20210022340-A1 USE OF PYRIDINE UREA COMPOUND HAVING SNAIL-KILLING ACTIVITY THE NATIONAL INSTITUTE OF PARASITIC DISEASES, CHINESE CENTER FOR DISEASE CONTROL AND PREVENTION (CN) 2021-01-28 US disclosed
EP-0682656-A1 USE OF PHENYL HETEROARYL UREAS AS 5HT 2C? RECEPTOR ANTAGONISTS AND UREA COMPOUNDS SMITHKLINE BEECHAM PLC (GB) 1995-11-22 EP disclosed
WO-1994018170-A1 USE OF PHENYL HETEROARYL UREAS AS 5HT2C RECEPTOR ANTAGONISTS AND UREA COMPOUNDS SMITHKLINE BEECHAM PLC (GB) 1994-08-18 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-20210022340-A1 USE OF PYRIDINE UREA COMPOUND HAVING SNAIL-KILLING ACTIVITY SLC14A1, UACA, UROD KMT2A 4029/4885MEN1 3057/4885RAB9A 1093/4885

“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.