SCHEMBL3114151

SCHEMBL3114151

CONc1cc(C(=O)Nc2cccc(N(C)C)c2)nc(N2CCOCC2)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.52
MAPT P10636 5/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
RAB9A P51151 2/20 0.50
HTT P42858 2/20 0.50
BRAF P15056 2/20 0.47
EPHX2 P34913 1/20 0.44
LMNA P02545 1/20 0.43
RAF1 P04049 1/20 0.43
BTK Q06187 2/20 0.42
CASR P41180 1/20 0.42
HTR1B P28222 1/20 0.42
NPC1 O15118 1/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
RECQL P46063 1/20 0.41
KDM4E B2RXH2 2/20 0.41
PIK3CA P42336 1/20 0.41
MTOR P42345 1/20 0.41

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
SCHEMBL1271602 0.85 AKT1 (0.61) AKT1MAPTSMN1; SMN2RAB9AHTT
SCHEMBL11926310 0.85 AKT1 (0.56) AKT1MAPTSMN1; SMN2RAB9AHTT
SCHEMBL11926387 0.82 NAPEPLD (0.51) AKT1MAPTSMN1; SMN2RAB9AHTT
SCHEMBL11926394 0.81 AKT1 (0.50) AKT1MAPTSMN1; SMN2RAB9AHTT
SCHEMBL11926388 0.80 NAPEPLD (0.55) AKT1MAPTSMN1; SMN2RAB9AHTT
SCHEMBL429028 0.80 EPHX2 (0.56) AKT1MAPTSMN1; SMN2RAB9AHTT
SCHEMBL11926298 0.77 AKT1 (0.47) AKT1MAPTSMN1; SMN2RAB9AHTT
SCHEMBL13439731 0.77 AKT1 (0.46) AKT1MAPTSMN1; SMN2RAB9AHTT
SCHEMBL11926309 0.76 AKT1 (0.54) AKT1MAPTSMN1; SMN2RAB9AHTT
SCHEMBL11926307 0.75 MAPT (0.52) AKT1MAPTSMN1; SMN2RAB9AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100256132-A1 IL-12 MODULATORY COMPOUNDS SYNTA PHARMACEUTICALS CORPORATION (US) 2010-10-07 US claimed
US-20060223996-A1 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2006-10-05 US claimed
US-8236795-B2 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2012-08-07 US disclosed
US-8236795-B2 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2012-08-07 US disclosed
US-8236795-B2 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2012-08-07 US disclosed
US-20100256132-A1 IL-12 MODULATORY COMPOUNDS SYNTA PHARMACEUTICALS CORPORATION (US) 2010-10-07 US disclosed
US-20100256132-A1 IL-12 MODULATORY COMPOUNDS SYNTA PHARMACEUTICALS CORPORATION (US) 2010-10-07 US disclosed
US-20100256132-A1 IL-12 MODULATORY COMPOUNDS SYNTA PHARMACEUTICALS CORPORATION (US) 2010-10-07 US disclosed
US-7696202-B2 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2010-04-13 US disclosed
US-7696202-B2 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2010-04-13 US disclosed
US-7696202-B2 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2010-04-13 US disclosed
EP-1819341-A2 IL-12 MODULATORY COMPOUNDS Synta Pharmaceuticals Corporation (US) 2007-08-22 EP disclosed
US-20060223996-A1 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2006-10-05 US disclosed
WO-2006053227-A2 IL-12 MODULATORY COMPOUNDS SYNTA PHARMACEUTICALS CORP. (US) 2006-05-18 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 (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-20060223996-A1 IL-12 modulatory compounds IL2, IL4, IFNG AKT1 1094/4885MAPT 3259/4885SMN1; SMN2 4828/4885
US-20100256132-A1 IL-12 MODULATORY COMPOUNDS IL2, IL4, IFNG AKT1 1094/4885MAPT 3259/4885SMN1; SMN2 4828/4885

“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.