SCHEMBL6262230

SCHEMBL6262230

NCC(O)COc1ccc(Br)cc1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.57
▸ MAPK1 P28482 3/20 0.54
▸ KDM4E B2RXH2 2/20 0.54
▸ TDP1 Q9NUW8 2/20 0.54
▸ KMT2A Q03164 5/20 0.53
▸ SMN1; SMN2 Q16637 3/20 0.53
▸ MEN1 O00255 3/20 0.53
▸ ALDH1A1 P00352 3/20 0.53
▸ HPGD P15428 2/20 0.53
▸ GAA P10253 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ TSHR P16473 2/20 0.51
▸ USP2 O75604 1/20 0.51
▸ POLB P06746 2/20 0.45
▸ LMNA P02545 2/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ ALOX15 P16050 1/20 0.44

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
SCHEMBL11127254 0.90 SMN1; SMN2 (0.61) MAPTKDM4EKMT2ASMN1; SMN2ALDH1A1
SCHEMBL6074318 0.82 PTGS1 (0.57) MAPTKDM4EKMT2ASMN1; SMN2TSHR
SCHEMBL12663858 0.82 MAPT (0.58) MAPTMAPK1KDM4ETDP1KMT2A
SCHEMBL6074194 0.82 PTGS1 (0.57) MAPTKDM4EKMT2ASMN1; SMN2TSHR
SCHEMBL1496796 0.82 MAPK1 (0.59) MAPTMAPK1KDM4ETDP1KMT2A
SCHEMBL18991198 0.82 MAPT (0.58) MAPTMAPK1KDM4ETDP1KMT2A
SCHEMBL1496588 0.82 MAPT (0.58) MAPTMAPK1KDM4ETDP1KMT2A
SCHEMBL16314627 0.81 SMN1; SMN2 (0.53) MAPTKDM4EKMT2ASMN1; SMN2ALDH1A1
SCHEMBL10770337 0.81 SMN1; SMN2 (0.53) MAPTKDM4EKMT2ASMN1; SMN2ALDH1A1
SCHEMBL1496558 0.81 MAPT (0.57) MAPTMAPK1KDM4ETDP1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11795169-B2 MAP4K4 inhibitors IMPERIAL COLLEGE INNOVATIONS LIMITED (GB) 2023-10-24 — — US disclosed
US-6962945-B2 N-aryloxypropanolyl-N′-phenethyl-urea COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2005-11-08 — — US disclosed
US-20050215631-A1 NOVEL N-ARYLOXYPROPANOLYL-N' - PHENETHYL - UREA COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2005-09-29 — — US disclosed
WO-2005063699-A1 N-ARYLOXYPROPANOLYL-N’-PHENETHYL-UREA COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2005-07-14 — — WO 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-20050215631-A1 NOVEL N-ARYLOXYPROPANOLYL-N' - PHENETHYL - UREA NPY4R, GPR119, MC4R MAPT 4471/4885MAPK1 2184/4885KDM4E 84/4885
US-11795169-B2 MAP4K4 inhibitors MAP4K4, MAP4K2, MAP4K5 MAPT 315/4885MAPK1 31/4885KDM4E 742/4885

“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.

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