SCHEMBL3577952

SCHEMBL3577952

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.43
FABP4 P15090 2/20 0.39
S1PR2 O95136 2/20 0.38
KDR P35968 2/20 0.38
ABL1 P00519 1/20 0.38
NTRK1 P04629 1/20 0.38
LCK P06239 1/20 0.38
FYN P06241 1/20 0.38
CSF1R P07333 1/20 0.38
LYN P07948 1/20 0.38
KIT P10721 1/20 0.38
SRC P12931 1/20 0.38
FLT1 P17948 1/20 0.38
FLT4 P35916 1/20 0.38
FLT3 P36888 1/20 0.38
BLK P51451 1/20 0.38
GRIK1 P39086 1/20 0.38
DHODH Q02127 1/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38

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
SCHEMBL3581872 0.93 CNR1 (0.41) CNR1GRIK1DHODHMEN1KMT2A
SCHEMBL3573189 0.90 CNR1 (0.43) CNR1FABP4KDRABL1NTRK1
SCHEMBL3581506 0.89 MAPT (0.43) KDRABL1NTRK1LCKFYN
SCHEMBL3577192 0.88 KDM4E (0.40) CNR1KDRMEN1KMT2AMAPT
SCHEMBL3573050 0.87 GRIK1 (0.41) CNR1KDRGRIK1MEN1KMT2A
SCHEMBL3582672 0.86 DGAT1 (0.42) KDRKITFLT3RAB9AP2RY1
SCHEMBL3580763 0.86 PSEN1 (0.45) KDRABL1NTRK1LCKFYN
SCHEMBL1463065 0.86 P2RY1 (0.45) GRIK1DHODHMEN1KMT2AMAPT
SCHEMBL3573627 0.84 P2RY1 (0.47) KDRABL1NTRK1LCKFYN
SCHEMBL3572047 0.84 KDR (0.51) KDR

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 680/4885FABP4 1144/4885S1PR2 2257/4885
US-20060178413-A1 Diphenylurea derivatives and their use as chloride channel blockers CLIC1, CLIC4, CLCN2 CNR1 392/4885FABP4 2144/4885S1PR2 1256/4885

“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.