SCHEMBL1384516

SCHEMBL1384516

N#Cc1cccc(N2CCN(C(=O)c3cn(Cc4cccnc4)cc3-c3ccccc3)CC2)c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 1/20 0.48
FNTA P49354 2/20 0.44
FNTB P49356 2/20 0.44
CHRM4 P08173 2/20 0.44
ALDH1A1 P00352 5/20 0.42
MEN1 O00255 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
SLC6A7 Q99884 1/20 0.41
CYP17A1 P05093 1/20 0.40
CYP21A2 P08686 1/20 0.40
CYP11B1 P15538 1/20 0.40
SMO Q99835 1/20 0.40
LMNA P02545 2/20 0.40
THRB P10828 1/20 0.40
ADORA2A P29274 1/20 0.40
MAPT P10636 3/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL1383360 0.85 NOTUM (0.46) CHRM4ALDH1A1MEN1KMT2ASLC6A7
SCHEMBL6502353 0.83 NOTUM (0.44) CHRM4ALDH1A1MEN1KMT2ASLC6A7
SCHEMBL6503881 0.82 ALDH1A1 (0.48) FNTAFNTBALDH1A1MEN1HTT
SCHEMBL6506210 0.76 CHRM4 (0.42) FNTAFNTBCHRM4MEN1KMT2A
SCHEMBL1380695 0.75 SLC6A9 (0.45) CHRM4ALDH1A1MEN1HTTKMT2A
SCHEMBL1382166 0.74 DRD2 (0.48) CHRM4ALDH1A1MEN1KMT2ASLC6A7
SCHEMBL1870287 0.73 CHRM4 (0.48) FNTAFNTBCHRM4ALDH1A1MEN1
SCHEMBL5820729 0.70 SLC6A9 (0.39) CHRM4ALDH1A1MEN1KMT2ASLC6A7
SCHEMBL1382820 0.70 SMO (0.49) CHRM4ALDH1A1MEN1KMT2ASLC6A7
SCHEMBL6166443 0.70 ELANE (0.44) FNTAFNTBMEN1KMT2ACYP11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4805813-B2 2011-11-02 JP claimed
EP-1641765-A1 ARYL-HETEROAROMATIC PRODUCTS, COMPOSITIONS CONTAINING SAME AND USE THEREOF Aventis Pharma S.A. (FR) 2006-04-05 EP claimed
US-20050014765-A1 Aryl-heteroaromatic products, compositions comprising them and use AVENTIS PHARMA S.A. (FR) 2005-01-20 US claimed
WO-2004108685-A1 ARYL-HETEROAROMATIC PRODUCTS, COMPOSITIONS CONTAINING SAME AND USE THEREOF AVENTIS PHARMA S.A. (FR) 2004-12-16 WO claimed
EP-1641765-A1 ARYL-HETEROAROMATIC PRODUCTS, COMPOSITIONS CONTAINING SAME AND USE THEREOF Aventis Pharma S.A. (FR) 2006-04-05 EP disclosed
US-20050014765-A1 Aryl-heteroaromatic products, compositions comprising them and use AVENTIS PHARMA S.A. (FR) 2005-01-20 US disclosed
WO-2004108685-A1 ARYL-HETEROAROMATIC PRODUCTS, COMPOSITIONS CONTAINING SAME AND USE THEREOF AVENTIS PHARMA S.A. (FR) 2004-12-16 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-20050014765-A1 Aryl-heteroaromatic products, compositions comprising them and use AHR, ARNT, MYC ABCG2 16/4885FNTA 1250/4885FNTB 1136/4885

“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.