SCHEMBL3581872

SCHEMBL3581872

O=C(Nc1cc(Cl)cc(Cl)c1)Nc1ccc(-c2ccc(Cl)cc2)cc1-c1nnn[nH]1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
MAPT P10636 3/20 0.40
RAB9A P51151 2/20 0.40
DHODH Q02127 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
P2RY1 P47900 1/20 0.39
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
GRIK1 P39086 1/20 0.37
RAF1 P04049 1/20 0.37
TRPV1 Q8NER1 1/20 0.37
MCHR1 Q99705 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL3577952 0.93 CNR1 (0.43) CNR1MEN1KMT2AMAPTRAB9A
SCHEMBL1463065 0.91 P2RY1 (0.45) MEN1KMT2AMAPTRAB9ADHODH
SCHEMBL3573189 0.90 CNR1 (0.43) CNR1MEN1KMT2AGRIK1
SCHEMBL3573050 0.90 GRIK1 (0.41) CNR1MEN1KMT2AMAPTRAB9A
SCHEMBL3581506 0.90 MAPT (0.43) MAPTP2RY1GRIK1
SCHEMBL3583939 0.88 KDM4E (0.49) CNR1MEN1KMT2AMAPTRAB9A
SCHEMBL3574142 0.88 PSEN1 (0.44) MEN1KMT2AGRIK1RAF1TRPV1
SCHEMBL3582672 0.87 DGAT1 (0.42) RAB9AP2RY1MCHR1
SCHEMBL3576165 0.86 GRIK1 (0.48) CNR1MAPTP2RY1GRIK1
SCHEMBL1463395 0.85 KMT2A (0.45) MEN1KMT2AMAPTRAB9ADHODH

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-20070293553-A1 Diphenylurea Derivatives Useful As Potassium Channel Activators NEUROSEARCH A/S (DK) 2007-12-20 US claimed
US-20060178413-A1 Diphenylurea derivatives and their use as chloride channel blockers NEUSEARCH A/S (DK) 2006-08-10 US claimed
US-7691891-B2 Diphenylurea derivatives and their use as chloride channel blockers NEUROSEARCH A/S (DK) 2010-04-06 US disclosed
US-20070293553-A1 Diphenylurea Derivatives Useful As Potassium Channel Activators NEUROSEARCH A/S (DK) 2007-12-20 US disclosed
US-20060178413-A1 Diphenylurea derivatives and their use as chloride channel blockers NEUSEARCH A/S (DK) 2006-08-10 US 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-20070293553-A1 Diphenylurea Derivatives Useful As Potassium Channel Activators KCNJ2, KCNH2, KCNH3 CNR1 680/4885MEN1 3855/4885KMT2A 603/4885
US-20060178413-A1 Diphenylurea derivatives and their use as chloride channel blockers CLIC1, CLIC4, CLCN2 CNR1 392/4885MEN1 3918/4885KMT2A 3025/4885

“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.