SCHEMBL2946771

SCHEMBL2946771

Nc1ccc(-c2cccc3c(NCCCN4CCOCC4)nccc23)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.49
TSHR P16473 4/20 0.49
ALOX15 P16050 2/20 0.49
TP53 P04637 2/20 0.49
SMN1; SMN2 Q16637 4/20 0.48
MAPT P10636 3/20 0.48
NPSR1 Q6W5P4 2/20 0.48
LMNA P02545 2/20 0.47
KDM4E B2RXH2 4/20 0.47
KMT2A Q03164 3/20 0.47
POLB P06746 2/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
GLA P06280 1/20 0.47
GAA P10253 1/20 0.47
RAD52 P43351 1/20 0.47
ALDH1A1 P00352 5/20 0.46
USP2 O75604 3/20 0.46
MEN1 O00255 2/20 0.46
HTT P42858 1/20 0.46

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
SCHEMBL2381103 0.82 EGFR (0.52) MAPK1TSHRALOX15TP53SMN1; SMN2
SCHEMBL12297373 0.80 KDM4E (0.52) MAPK1TSHRALOX15TP53SMN1; SMN2
SCHEMBL20966396 0.75 TSHR (0.53) MAPK1TSHRALOX15TP53SMN1; SMN2
SCHEMBL2381779 0.73 GLA (0.49) TSHRTP53SMN1; SMN2MAPTNPSR1
SCHEMBL12245702 0.73 MAPK14 (0.42) MAPK1TSHRALOX15TP53SMN1; SMN2
SCHEMBL31565201 0.73 MAPT (0.56) MAPK1TSHRALOX15TP53MAPT
SCHEMBL1257160 0.72 KDR (0.50) NPSR1LMNAKDM4EKMT2APOLB
SCHEMBL3234489 0.71 NPC1 (0.51) MAPK1TSHRALOX15SMN1; SMN2MAPT
SCHEMBL3971420 0.70 IRAK4 (0.58) MAPK1TSHRALOX15TP53SMN1; SMN2
SCHEMBL4272871 0.69 HRH4 (0.54) TSHRALOX15MAPTNPSR1LMNA

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
US-7759344-B2 Bis-aryl amide derivatives and methods of use AMGEN INC. (US) 2010-07-20 US disclosed
US-7759344-B2 Bis-aryl amide derivatives and methods of use AMGEN INC. (US) 2010-07-20 US disclosed
US-7759344-B2 Bis-aryl amide derivatives and methods of use AMGEN INC. (US) 2010-07-20 US disclosed
US-20080234268-A1 Bis-aryl amide derivatives and methods of use AMGEN INC. (US) 2008-09-25 US disclosed
US-20080234268-A1 Bis-aryl amide derivatives and methods of use AMGEN INC. (US) 2008-09-25 US disclosed
US-20080234268-A1 Bis-aryl amide derivatives and methods of use AMGEN INC. (US) 2008-09-25 US disclosed
WO-2008086014-A2 BIS-ARYL AMIDE DERIVATIVES USEFUL FOR THE TREATMENT OF CANCER AMGEN INC. (US) 2008-07-17 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-20080234268-A1 Bis-aryl amide derivatives and methods of use MET, REL, NAT1 MAPK1 2606/4885TSHR 1900/4885ALOX15 1670/4885

“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.