SCHEMBL6112331

SCHEMBL6112331

NC(=O)N(Cc1ccccc1)c1ccc2[nH]c(=O)ccc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
RXFP1 Q9HBX9 2/20 0.51
AR P10275 2/20 0.47
TP53 P04637 1/20 0.47
PKM P14618 1/20 0.44
ACHE P22303 1/20 0.41
MAOB P27338 1/20 0.41
IDO1 P14902 1/20 0.40
CA12 O43570 2/20 0.40
CA9 Q16790 2/20 0.40
CA1 P00915 1/20 0.40
CA3 P07451 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40
CA7 P43166 1/20 0.40
CA13 Q8N1Q1 1/20 0.40
CA14 Q9ULX7 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
LMNA P02545 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
SCHEMBL6111381 0.89 POLB (0.50) POLBRXFP1ARTP53PKM
SCHEMBL9547649 0.81 PTGES (0.47) ACHEALDH1A1HTTPDK1
SCHEMBL6110886 0.75 ALDH1A1 (0.50) TP53ACHEMAOBCA12CA9
SCHEMBL23320564 0.75 NAMPT (0.53) IDO1LMNAMEN1KMT2AKDM4E
SCHEMBL6083112 0.74 AR (0.51) POLBRXFP1ARTP53PKM
SCHEMBL1385749 0.73 ALDH1A1 (0.62) MEN1KMT2AALDH1A1HTTPDK1
SCHEMBL4362240 0.72 SLC6A2 (0.55)
Hydrochloric Acid SCHEMBL27540694 0.71 NPC1 (0.61) MEN1KMT2AALDH1A1HTTPDK1
SCHEMBL27323388 0.69 NPC1 (0.50) ALDH1A1HTTPDK1
SCHEMBL5761343 0.69 PKM (0.55) POLBRXFP1ARTP53PKM

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-7115745-B2 Benzyl urea and thiourea derivatives WARNER LAMBERT COMPANY LLC (US) 2006-10-03 US disclosed
EP-1597233-A1 BENZYL UREA AND THIOUREA DERIVATIVES USEFUL AS ANDROGEN ANTAGONISTS Warner-Lambert Company LLC (US) 2005-11-23 EP disclosed
US-20050107427-A1 Benzyl urea and thiourea derivatives DU DANIEL Y (US) 2005-05-19 US disclosed
WO-2004072043-A1 BENZYL UREA AND THIOUREA DERIVATIVES USEFUL AS ANDROGEN ANTAGONISTS WARNER-LAMBERT COMPANY LLC (US) 2004-08-26 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 (1 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-20050107427-A1 Benzyl urea and thiourea derivatives BRDT, TAS2R8, FSHR POLB 2061/4885RXFP1 1679/4885AR 9/4885

“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.