SCHEMBL4922780

SCHEMBL4922780

Cn1ncc2cc(NC(=O)Nc3ccc(Cl)cc3)ccc21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 3/20 0.59
▸ MAOA P21397 2/20 0.59
▸ ACHE P22303 1/20 0.59
▸ HTR2A P28223 8/20 0.56
▸ HTR2C P28335 7/20 0.56
▸ KMT2A Q03164 3/20 0.56
▸ MEN1 O00255 2/20 0.54
▸ MAPT P10636 2/20 0.54
▸ NPC1 O15118 2/20 0.54
▸ ALDH1A1 P00352 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ ALOX12 P18054 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ NOTUM Q6P988 1/20 0.52
▸ TRPV1 Q8NER1 1/20 0.52
▸ MAPK13 O15264 1/20 0.51
▸ MAPK12 P53778 1/20 0.51
▸ MAPK11 Q15759 1/20 0.51
▸ MAPK14 Q16539 1/20 0.51
▸ TRPM5 Q9NZQ8 1/20 0.50

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
SCHEMBL4048302 0.83 HTR2A (0.55) MAOBMAOAACHEHTR2AHTR2C
SCHEMBL16686040 0.81 NPC1 (0.63) MAOBMAOAACHEMAPTNPC1
SCHEMBL4915737 0.78 HTR2A (0.49) HTR2AHTR2CKMT2AMAPTNPC1
SCHEMBL26630402 0.77 NPC1 (0.55) MAOBMAOAACHEMAPTNPC1
SCHEMBL13106085 0.77 TRPM5 (0.64) MAOBMAOAACHEKMT2AMEN1
SCHEMBL13106663 0.76 CES1 (0.53) HTR2AHTR2CKMT2AMEN1ALDH1A1
SCHEMBL29510910 0.76 NPC1 (0.78) MAOBMAOAACHEKMT2AMEN1
SCHEMBL31036105 0.76 NOTUM (0.61) MAOBMAOAACHEKMT2AMEN1
SCHEMBL13106151 0.76 KMO (0.51) MAOBMAOAACHEKMT2AMAPT
SCHEMBL16406932 0.75 NOTUM (0.54) MAOBMAOAACHEMAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120214808-A1 Aryl Urea Derivatives for Treating Obesity PROSIDION LIMITED (GB) 2012-08-23 — — US claimed
US-20080261952-A1 Aryl Urea Derivatives for Treating Obesity PROSIDION LTD. (GB) 2008-10-23 — — US claimed
US-20120214808-A1 Aryl Urea Derivatives for Treating Obesity PROSIDION LIMITED (GB) 2012-08-23 — — US disclosed
US-20080261952-A1 Aryl Urea Derivatives for Treating Obesity PROSIDION LTD. (GB) 2008-10-23 — — US disclosed
EP-1786422-A2 ARYL UREA DERIVATIVES FOR TREATING OBESITY Prosidion Limited (GB) 2007-05-23 — — EP disclosed
WO-2006018662-A2 ARYL UREA DERIVATIVES FOR TREATING OBESITY PROSIDION LIMITED (GB) 2006-02-23 — — 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-20080261952-A1 Aryl Urea Derivatives for Treating Obesity CNR1, GPR119, UTS2R MAOB 1455/4885MAOA 2160/4885ACHE 2646/4885
US-20120214808-A1 Aryl Urea Derivatives for Treating Obesity CNR1, GPR119, UTS2R MAOB 1455/4885MAOA 2160/4885ACHE 2646/4885

“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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