SCHEMBL5457788

SCHEMBL5457788

NC(=O)c1c(NC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)sc2c1CCSC2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.45
PTPRA P18433 1/20 0.45
KCNH2 Q12809 8/20 0.42
TNIK Q9UKE5 1/20 0.42
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
EPHB4 P54760 1/20 0.41
MAPT P10636 3/20 0.41
KDM4E B2RXH2 2/20 0.41
USP2 O75604 1/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
ATM Q13315 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
FLT3 P36888 2/20 0.39

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
SCHEMBL5462800 0.90 KMT2A (0.48) KCNH2TNIKMEN1KMT2ANPC1
SCHEMBL5454155 0.89 KCNH2 (0.49) PTPN1PTPRAKCNH2TNIKMEN1
SCHEMBL5458235 0.86 FLT3 (0.55) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL5450963 0.84 KCNH2 (0.50) PTPN1PTPRAKCNH2TNIKMEN1
SCHEMBL5451368 0.84 CHRNA7 (0.47) PTPN1PTPRAKCNH2MEN1KMT2A
SCHEMBL5450945 0.83 CFTR (0.54) PTPN1KCNH2MEN1KMT2ANPC1
SCHEMBL5456002 0.82 KDR (0.53) KCNH2MEN1KMT2AMAPTKDM4E
SCHEMBL5447105 0.81 KMT2A (0.58) PTPN1PTPRAKCNH2TNIKMEN1
SCHEMBL5460961 0.81 FLT3 (0.55) PTPN1PTPRAKCNH2TNIKMEN1
SCHEMBL5447330 0.79 FLT3 (0.47) PTPN1PTPRAKCNH2TNIKMEN1

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 2 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
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 PTPN1 2192/4885PTPRA 2633/4885KCNH2 3409/4885

“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.