SCHEMBL13556629

SCHEMBL13556629

O=C(Nc1ccc(Oc2ccccc2)cc1)Nc1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 8/20 0.72
KDR P35968 8/20 0.72
CDK8 P49336 4/20 0.70
CA7 P43166 3/20 0.67
CA9 Q16790 3/20 0.67
CA1 P00915 2/20 0.67
CA2 P00918 2/20 0.67
MEN1 O00255 1/20 0.64
PLK4 O00444 1/20 0.64
CIT O14578 1/20 0.64
AURKA O14965 1/20 0.64
MUSK O15146 1/20 0.64
EPHB6 O15197 1/20 0.64
MAPK13 O15264 1/20 0.64
MLNR O43193 1/20 0.64
MAP3K7 O43318 1/20 0.64
RIPK2 O43353 1/20 0.64
DYRK3 O43781 1/20 0.64
PDE6D O43924 1/20 0.64
NR1I2 O75469 1/20 0.64

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
SCHEMBL31504026 0.90 KDR (0.68) RAF1KDRCDK8CA7CA9
SCHEMBL16621058 0.90 KDR (0.68) RAF1KDRCDK8CA7CA9
SCHEMBL6014335 0.90 RAF1 (0.79) RAF1KDRCDK8FLT1EPHX2
SCHEMBL18615348 0.89 KDR (0.85) KDRCA7CA9CA1CA2
SCHEMBL16628140 0.89 KDR (0.70) RAF1KDRCDK8CA7CA9
SCHEMBL938819 0.89 KDR (0.70) RAF1KDRCDK8CA7CA9
SCHEMBL13524681 0.88 RAF1 (0.74) RAF1KDRCDK8CA7CA9
SCHEMBL936533 0.88 RAF1 (0.73) RAF1KDRCDK8CA7CA9
SCHEMBL30462521 0.88 RAF1 (0.73) RAF1KDRCDK8CA7CA9
SCHEMBL16628062 0.87 RAF1 (0.76) RAF1KDRCDK8CA7CA9

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12187696-B2 Urea motif containing compounds and derivatives thereof as antibacterial drugs Technische Universität München (DE) 2025-01-07 US disclosed
US-20230330061-A1 ANTIMICROBIAL COMPOSITIONS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF NATIONAL TAIWAN UNIVERSITY (TW) 2023-10-19 US disclosed
US-20230330061-A1 ANTIMICROBIAL COMPOSITIONS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF NATIONAL TAIWAN UNIVERSITY (TW) 2023-10-19 US disclosed
EP-3464260-B1 UREA MOTIF CONTAINING COMPOUNDS AND DERIVATIVES THEREOF AS ANTIBACTERIAL DRUGS UNIV MUENCHEN TECH (DE) 2021-10-27 EP disclosed
EP-3464260-B1 UREA MOTIF CONTAINING COMPOUNDS AND DERIVATIVES THEREOF AS ANTIBACTERIAL DRUGS UNIV MUENCHEN TECH (DE) 2021-10-27 EP disclosed
US-20210009550-A1 UREA MOTIF CONTAINING COMPOUNDS AND DERIVATIVES THEREOF AS ANTIBACTERIAL DRUGS Technische Universität München (DE) 2021-01-14 US disclosed
US-20210009550-A1 UREA MOTIF CONTAINING COMPOUNDS AND DERIVATIVES THEREOF AS ANTIBACTERIAL DRUGS Technische Universität München (DE) 2021-01-14 US disclosed
CN-109890804-A Compounds containing urea moieties and derivatives thereof as antibacterial agents 慕尼黑工业大学 2019-06-14 CN disclosed
EP-3464260-A2 UREA MOTIF CONTAINING COMPOUNDS AND DERIVATIVES THEREOF AS ANTIBACTERIAL DRUGS Technische Universität München (DE) 2019-04-10 EP disclosed
WO-2017207556-A2 UREA MOTIF CONTAINING COMPOUNDS AND DERIVATIVES THEREOF AS ANTIBACTERIAL DRUGS Technische Universität München (DE) 2017-12-07 WO disclosed
WO-2017207556-A2 UREA MOTIF CONTAINING COMPOUNDS AND DERIVATIVES THEREOF AS ANTIBACTERIAL DRUGS Technische Universität München (DE) 2017-12-07 WO disclosed
WO-2015051149-A1 SORAFENIB ANALOGS AND USES THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2015-04-09 WO disclosed
US-20120270878-A1 INHIBITION OF P38 KINASE USING SYMMETRICAL AND UNSYMMETRICAL DIPHENYL UREAS BAYER HEALTHERCARE LLC (US) 2012-10-25 US disclosed
US-7517880-B2 Inhibition of p38 kinase using symmetrical and unsymmetrical diphenyl ureas BAYER PHARMACEUTICALS CORPORATION (US) 2009-04-14 US disclosed
US-7517880-B2 Inhibition of p38 kinase using symmetrical and unsymmetrical diphenyl ureas BAYER PHARMACEUTICALS CORPORATION (US) 2009-04-14 US disclosed
US-20090093526-A1 INHIBITION OF P38 KINASE USING SYMMETRICAL AND UNSYMMETRICAL DIPHENYL UREAS BAYER HEALTHCARE LLC 2009-04-09 US disclosed
US-20090093526-A1 INHIBITION OF P38 KINASE USING SYMMETRICAL AND UNSYMMETRICAL DIPHENYL UREAS BAYER HEALTHCARE LLC 2009-04-09 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 (5 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-20090093526-A1 INHIBITION OF P38 KINASE USING SYMMETRICAL AND UNSYMMETRICAL DIPHENYL UREAS MAP2K2, MAPK1, MAP2K1 RAF1 514/4885KDR 3299/4885CDK8 449/4885
US-20230330061-A1 ANTIMICROBIAL COMPOSITIONS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF FASN, NAAA, FPR3 RAF1 1167/4885KDR 4172/4885CDK8 3532/4885
US-20210009550-A1 UREA MOTIF CONTAINING COMPOUNDS AND DERIVATIVES THEREOF AS ANTIBACTERIAL DRUGS UMPS, UNG, UFM1 RAF1 983/4885KDR 3399/4885CDK8 1606/4885
US-20120270878-A1 INHIBITION OF P38 KINASE USING SYMMETRICAL AND UNSYMMETRICAL DIPHENYL UREAS MAP2K2, MAPK1, MAP2K1 RAF1 514/4885KDR 3299/4885CDK8 449/4885
US-12187696-B2 Urea motif containing compounds and derivatives thereof as antibacterial drugs UMPS, UNG, UFM1 RAF1 983/4885KDR 3399/4885CDK8 1606/4885

“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.