SCHEMBL3584913

SCHEMBL3584913

O=C(Nc1ccccc1Cl)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 2/20 0.47
MAPT P10636 4/20 0.43
GAA P10253 4/20 0.43
TP53 P04637 1/20 0.43
NTRK1 P04629 2/20 0.41
RET P07949 1/20 0.41
PDGFRB P09619 1/20 0.41
PDGFRA P16234 1/20 0.41
CDK8 P49336 1/20 0.41
NTRK3 Q16288 1/20 0.41
MAPK14 Q16539 1/20 0.41
NTRK2 Q16620 1/20 0.41
KIF11 P52732 3/20 0.40
POLB P06746 1/20 0.40
ALDH1A1 P00352 5/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
KDM4E B2RXH2 3/20 0.39
HSD17B10 Q99714 2/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL3575221 0.89 ALDH1A1 (0.43) KDRMAPTTP53NTRK2KIF11
SCHEMBL3581070 0.89 KIF11 (0.48) KDRNTRK1RETPDGFRBPDGFRA
SCHEMBL3577192 0.89 KDM4E (0.40) KDRMAPTGAATP53POLB
SCHEMBL3583939 0.89 KDM4E (0.49) KDRMAPTGAAPOLBALDH1A1
SCHEMBL3581506 0.88 MAPT (0.43) KDRMAPTGAATP53NTRK1
SCHEMBL3574323 0.88 KIF11 (0.40) MAPTGAAKIF11MEN1KMT2A
SCHEMBL3579491 0.87 PSEN1 (0.47) KDRMAPTNTRK1RETPDGFRB
SCHEMBL3584626 0.87 RAB9A (0.43) KDRMAPTGAAPDGFRBPOLB
SCHEMBL3576165 0.86 GRIK1 (0.48) KDRMAPTNTRK1RETPDGFRB
SCHEMBL3584713 0.85 MTOR (0.41) KDRMAPTNTRK1RETPDGFRB

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 1142/4885MAPT 109/4885GAA 1448/4885
US-20060178413-A1 Diphenylurea derivatives and their use as chloride channel blockers CLIC1, CLIC4, CLCN2 KDR 2480/4885MAPT 3250/4885GAA 2528/4885

“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.