SCHEMBL3583514

SCHEMBL3583514

Cc1ccc(-c2ccc(NC(=O)Nc3ccccc3Br)c(-c3nnn[nH]3)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.43
NPC1 O15118 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
CXCR1 P25024 5/20 0.41
CXCR2 P25025 6/20 0.40
KMT2A Q03164 5/20 0.40
HTT P42858 4/20 0.40
MEN1 O00255 4/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 3/20 0.39
GAA P10253 2/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
ALDH1A1 P00352 2/20 0.38
ADRB3 P13945 1/20 0.38
TSPO P30536 1/20 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
SCHEMBL3581312 0.90 CXCR2 (0.50) RAB9ANPC1SMN1; SMN2CXCR1CXCR2
SCHEMBL3577178 0.90 HTT (0.44) RAB9ANPC1SMN1; SMN2CXCR1CXCR2
SCHEMBL3584536 0.88 MAPT (0.45) RAB9ANPC1SMN1; SMN2KMT2AHTT
SCHEMBL3584626 0.88 RAB9A (0.43) RAB9ANPC1SMN1; SMN2KMT2AHTT
SCHEMBL3574323 0.87 KIF11 (0.40) RAB9ANPC1SMN1; SMN2CXCR1CXCR2
SCHEMBL3578975 0.85 ALDH1A1 (0.47) RAB9ANPC1KMT2AHTTMEN1
SCHEMBL1463379 0.85 CXCR1 (0.49) RAB9ANPC1SMN1; SMN2CXCR1CXCR2
SCHEMBL13404779 0.80 MGLL (0.47) RAB9ANPC1SMN1; SMN2CXCR2HTT
SCHEMBL3583939 0.79 KDM4E (0.49) RAB9ANPC1SMN1; SMN2CXCR2KMT2A
SCHEMBL3575264 0.79 RAB9A (0.48) RAB9ANPC1SMN1; SMN2KMT2AHTT

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 RAB9A 3911/4885NPC1 808/4885SMN1; SMN2 2422/4885
US-20060178413-A1 Diphenylurea derivatives and their use as chloride channel blockers CLIC1, CLIC4, CLCN2 RAB9A 4081/4885NPC1 434/4885SMN1; SMN2 4510/4885

“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.