SCHEMBL4511784

SCHEMBL4511784

CC[C@@H](N)CNc1nc(-c2cc(-c3ccc(F)cc3)ccc2O)nc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
RXFP1 Q9HBX9 2/20 0.46
CHEK2 O96017 7/20 0.46
CHEK1 O14757 6/20 0.46
ACP1 P24666 1/20 0.46
PRKD3 O94806 2/20 0.45
PRKD1 Q15139 2/20 0.45
PRKD2 Q9BZL6 2/20 0.45
EGFR P00533 2/20 0.45
MAPT P10636 3/20 0.44
LMNA P02545 1/20 0.44
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL4511786 1.00 MEN1 (0.46) MEN1KMT2ARXFP1CHEK2CHEK1
SCHEMBL4511790 1.00 MEN1 (0.46) MEN1KMT2ARXFP1CHEK2CHEK1
SCHEMBL4514611 0.95 ACP1 (0.51) MEN1KMT2ARXFP1CHEK2CHEK1
SCHEMBL4514616 0.95 ACP1 (0.51) MEN1KMT2ARXFP1CHEK2CHEK1
SCHEMBL4514622 0.95 ACP1 (0.51) MEN1KMT2ARXFP1CHEK2CHEK1
SCHEMBL8227557 0.95 ACP1 (0.51) MEN1KMT2ARXFP1CHEK2CHEK1
SCHEMBL4510863 0.93 ACP1 (0.46) MEN1KMT2ARXFP1CHEK2CHEK1
SCHEMBL4510864 0.93 ACP1 (0.46) MEN1KMT2ARXFP1CHEK2CHEK1
SCHEMBL4510858 0.93 ACP1 (0.46) MEN1KMT2ARXFP1CHEK2CHEK1
SCHEMBL4508015 0.93 MEN1 (0.47) MEN1KMT2ARXFP1CHEK2CHEK1

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-20090247519-A1 AMINO-ETHYL-AMINO-ARYL (AEAA) COMPOUNDS AND THEIR USE CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2009-10-01 US disclosed
US-20090247519-A1 AMINO-ETHYL-AMINO-ARYL (AEAA) COMPOUNDS AND THEIR USE CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2009-10-01 US disclosed
US-20090247519-A1 AMINO-ETHYL-AMINO-ARYL (AEAA) COMPOUNDS AND THEIR USE CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2009-10-01 US disclosed
WO-2007125331-A2 AMINO-ETHYL-AMINO-ARYL (AEAA) COMPOUNDS AND THEIR USE CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2007-11-08 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-20090247519-A1 AMINO-ETHYL-AMINO-ARYL (AEAA) COMPOUNDS AND THEIR USE PKD2, PKD1, AADAT MEN1 4237/4885KMT2A 230/4885RXFP1 3771/4885

“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.