SCHEMBL15079490

SCHEMBL15079490

Nc1ccc(-c2cn3c(n2)sc2nc(Cl)ccc23)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.44
TP53 P04637 6/20 0.44
RAB9A P51151 4/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
NPC1 O15118 3/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
LMNA P02545 3/20 0.38
TSHR P16473 1/20 0.38
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
APP P05067 3/20 0.38
RXFP1 Q9HBX9 1/20 0.36
ADORA2A P29274 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
FLT3 P36888 2/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35

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
SCHEMBL13394343 0.86 MAPT (0.43) MAPTTP53RAB9ASMN1; SMN2NPC1
SCHEMBL24741107 0.83 LMNA (0.43) MAPTTP53RAB9ASMN1; SMN2NPC1
SCHEMBL15079505 0.81 F2RL3 (0.46) MAPTRAB9ASMN1; SMN2NPC1MEN1
SCHEMBL24741110 0.79 LMNA (0.48) MAPTTP53RAB9ASMN1; SMN2NPC1
SCHEMBL15079492 0.77 FLT3 (0.49) MAPTTP53RAB9ASMN1; SMN2NPC1
SCHEMBL13394339 0.74 ADORA2A (0.41) MAPTRAB9ASMN1; SMN2NPC1MEN1
SCHEMBL74089 0.73 MAPT (0.52) MAPTTP53RAB9ASMN1; SMN2NPC1
SCHEMBL15079506 0.73 FLT3 (0.42) MAPTTP53RAB9ASMN1; SMN2NPC1
SCHEMBL13394336 0.72 MAPT (0.45) MAPTTP53RAB9ASMN1; SMN2NPC1
SCHEMBL20303360 0.72 FLT3 (0.53) MAPTTP53RAB9ASMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2763998-B1 TRI-HETEROCYCLIC DERIVATIVES, PREPARATION PROCESS AND USES THEREOF SHANGHAI DE NOVO PHARMATECH CO LTD (CN) 2016-04-27 EP disclosed
US-9216997-B2 Tri-heterocyclic derivatives, preparation process and uses thereof SHANGHAI DE NOVO PHARMATECH CO LTD. (CN) 2015-12-22 US disclosed
US-9216997-B2 Tri-heterocyclic derivatives, preparation process and uses thereof SHANGHAI DE NOVO PHARMATECH CO LTD. (CN) 2015-12-22 US disclosed
US-20140329800-A1 TRI-HETEROCYCLIC DERIVATIVES, PREPARATION PROCESS AND USES THEREOF SHANGHAI DE NOVO PHARMATECH CO LTD. (CN) 2014-11-06 US disclosed
US-20140329800-A1 TRI-HETEROCYCLIC DERIVATIVES, PREPARATION PROCESS AND USES THEREOF SHANGHAI DE NOVO PHARMATECH CO LTD. (CN) 2014-11-06 US disclosed
WO-2013091502-A1 TRI-HETEROCYCLIC DERIVATIVES, PREPARATION PROCESS AND USES THEREOF SHANGHAI DE NOVO PHARMATECH CO LTD. (CN) 2013-06-27 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-20140329800-A1 TRI-HETEROCYCLIC DERIVATIVES, PREPARATION PROCESS AND USES THEREOF MAP3K15, MAP3K1, MAP3K5 MAPT 2207/4885TP53 2157/4885RAB9A 1502/4885

“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.