SCHEMBL3584463

SCHEMBL3584463

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 11/20 0.47
BLM P54132 1/20 0.46
WRN Q14191 1/20 0.46
FLT3 P36888 7/20 0.45
CSF1R P07333 4/20 0.45
FLT1 P17948 4/20 0.45
FLT4 P35916 4/20 0.45
RET P07949 2/20 0.45
NTRK3 Q16288 2/20 0.45
AURKB Q96GD4 2/20 0.45
FGFR1 P11362 1/20 0.45
FRK P42685 1/20 0.45
CAMK2B Q13554 1/20 0.45
CAMK2D Q13557 1/20 0.45
HIPK4 Q8NE63 1/20 0.45
RIPK1 Q13546 2/20 0.43
NTRK1 P04629 1/20 0.42
PDGFRB P09619 1/20 0.42
LTK P29376 1/20 0.42
CDK8 P49336 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
SCHEMBL3581862 0.94 KDR (0.48) KDRBLMWRNFLT3CSF1R
SCHEMBL3579515 0.93 KDR (0.47) KDRBLMWRNFLT3CSF1R
SCHEMBL3586253 0.92 KDR (0.47) KDRBLMWRNFLT3CSF1R
SCHEMBL3581507 0.90 KDR (0.51) KDRBLMRIPK1BRAFRAF1
SCHEMBL3576165 0.88 GRIK1 (0.48) KDRFLT3CSF1RFLT1FLT4
SCHEMBL5469601 0.88 KDR (0.46) KDRBLMWRNFLT3CSF1R
SCHEMBL3584713 0.87 MTOR (0.41) KDRFLT3CSF1RFLT1FLT4
SCHEMBL3579491 0.86 PSEN1 (0.47) KDRFLT3CSF1RFLT1FLT4
SCHEMBL3577053 0.86 KDR (0.51) KDRFLT3CSF1RFLT1FLT4
SCHEMBL1463403 0.86 KDR (0.45) KDRBLMWRNFLT3CSF1R

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 KDR 1142/4885BLM 4646/4885WRN 4582/4885
US-20060178413-A1 Diphenylurea derivatives and their use as chloride channel blockers CLIC1, CLIC4, CLCN2 KDR 2480/4885BLM 3286/4885WRN 4153/4885

“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.