SCHEMBL2825501

SCHEMBL2825501

Fc1ccccc1Nc1nc(Cl)nc2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.60
HTR2A P28223 3/20 0.55
MAPT P10636 4/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
HTT P42858 2/20 0.54
ALDH1A1 P00352 1/20 0.54
C1R P00736 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
PDE5A O76074 2/20 0.51
APP P05067 2/20 0.51
RAD52 P43351 1/20 0.50
LATS1 O95835 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
TP53 P04637 1/20 0.47
ABCG2 Q9UNQ0 2/20 0.45

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
SCHEMBL31471933 1.00 LMNA (0.60) LMNAHTR2AMAPTNPC1RAB9A
SCHEMBL9776701 0.81 SLC2A1 (0.59) LMNANPC1RAB9AC1RPDE5A
Hydrochloric Acid SCHEMBL9776744 0.80 SLC2A1 (0.62) LMNANPC1RAB9AC1RPDE5A
SCHEMBL2257238 0.78 NPY5R (0.66) MAPTALDH1A1PDE5AAPPSMN1; SMN2
SCHEMBL30960995 0.78 NPY5R (0.66) MAPTALDH1A1PDE5AAPPSMN1; SMN2
SCHEMBL16937298 0.78 PTGS2 (0.64) LMNAMAPTPDE5AAPPSMN1; SMN2
SCHEMBL9776796 0.78 MEN1 (0.60) MAPTPDE5AAPPSMN1; SMN2KDM4E
SCHEMBL3106418 0.78 MAPT (0.69) LMNAHTR2AMAPTHTTALDH1A1
SCHEMBL20299032 0.76 ABCG2 (0.68) LMNAMAPTNPC1RAB9AALDH1A1
SCHEMBL22201652 0.76 LMNA (1.00) LMNAMAPTALDH1A1PDE5ALATS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130096100-A1 DI(ARYLAMINO)ARYL COMPOUND ASTELLAS PHARMA INC. (JP) 2013-04-18 US disclosed
US-8318702-B2 Di(arylamino)aryl compounds ASTELLAS PHARMA INC. (JP) 2012-11-27 US disclosed
US-8318702-B2 Di(arylamino)aryl compounds ASTELLAS PHARMA INC. (JP) 2012-11-27 US disclosed
US-8318702-B2 Di(arylamino)aryl compounds ASTELLAS PHARMA INC. (JP) 2012-11-27 US disclosed
CN-101687822-B Di(arylamino)aryl compound ASTELLAS PHARMA INC 2012-11-07 CN disclosed
US-20100099658-A1 DI(ARYLAMINO)ARYL COMPOUND ASTELLAS PHARMA INC. (JP) 2010-04-22 US disclosed
US-20100099658-A1 DI(ARYLAMINO)ARYL COMPOUND ASTELLAS PHARMA INC. (JP) 2010-04-22 US disclosed
US-20100099658-A1 DI(ARYLAMINO)ARYL COMPOUND ASTELLAS PHARMA INC. (JP) 2010-04-22 US disclosed
EP-2172461-A1 DI(ARYLAMINO)ARYL COMPOUND Astellas Pharma Inc. (JP) 2010-04-07 EP disclosed
CN-101687822-A Di(arylamino)aryl compound ASTELLAS PHARMA INC 2010-03-31 CN 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-20130096100-A1 DI(ARYLAMINO)ARYL COMPOUND ERBB4, EGFR, ALK LMNA 2407/4885HTR2A 4451/4885MAPT 3344/4885
US-20100099658-A1 DI(ARYLAMINO)ARYL COMPOUND ERBB4, EGFR, ALK LMNA 2407/4885HTR2A 4451/4885MAPT 3344/4885

“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.