SCHEMBL5456042

SCHEMBL5456042

NC(=O)c1c(NC(=O)c2c[nH]nc2N)sc2c1CCCC2

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 11/20 0.60
NPC1 O15118 6/20 0.59
RAB9A P51151 6/20 0.59
CFTR P13569 1/20 0.59
KMT2A Q03164 2/20 0.59
ALDH1A1 P00352 3/20 0.58
MAPT P10636 3/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
HPGD P15428 1/20 0.58
POLB P06746 1/20 0.57
KDM4E B2RXH2 1/20 0.56
LMNA P02545 1/20 0.56
ALOX15 P16050 1/20 0.56
TSHR P16473 1/20 0.56
HSD17B10 Q99714 1/20 0.56
PDE4B Q07343 1/20 0.55
PDE4D Q08499 1/20 0.55
MEN1 O00255 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2C19 P33261 1/20 0.55

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
SCHEMBL5453550 0.79 FLT3 (0.67) FLT3NPC1RAB9AKMT2AALDH1A1
SCHEMBL8290390 0.77 FLT3 (0.67) FLT3NPC1RAB9ACFTRKMT2A
SCHEMBL5453533 0.76 FLT3 (0.67) FLT3NPC1RAB9ACFTRKMT2A
SCHEMBL5460003 0.75 FLT3 (0.78) FLT3NPC1RAB9ACFTRKMT2A
SCHEMBL5453093 0.75 FLT3 (1.00) FLT3NPC1RAB9ACFTRKMT2A
SCHEMBL8288764 0.75 FLT3 (0.78) FLT3NPC1RAB9ACFTRKMT2A
SCHEMBL8289720 0.75 NPC1 (0.73) FLT3NPC1RAB9ACFTRKMT2A
SCHEMBL5467221 0.74 FLT3 (0.70) FLT3NPC1RAB9AKMT2AALDH1A1
SCHEMBL3110880 0.74 CFTR (1.00) FLT3NPC1RAB9ACFTRKMT2A
SCHEMBL5450662 0.74 ALDH1A1 (0.67) FLT3NPC1RAB9ACFTRKMT2A

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-20070275962-A1 Heterobicyclic Compounds as Pharmaceutically Active Agents GPC BIOTECH AG (DE) 2007-11-29 US claimed
EP-1294707-A2 THIOPHENE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Pharmacia Italia S.p.A. (IT) 2003-03-26 EP claimed
WO-2001098290-A2 THIOPHENE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PHARMACIA ITALIA S.P.A. (IT) 2001-12-27 WO claimed
US-20070275962-A1 Heterobicyclic Compounds as Pharmaceutically Active Agents GPC BIOTECH AG (DE) 2007-11-29 US 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-20070275962-A1 Heterobicyclic Compounds as Pharmaceutically Active Agents TBCA, PARK7, NFATC1 FLT3 3509/4885NPC1 2627/4885RAB9A 948/4885

“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.