SCHEMBL5446202

SCHEMBL5446202

O=C(Nc1ccc(F)c(C(F)(F)F)c1)Nc1nnc(COc2ccc(Cl)cc2)s1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.59
RAB9A P51151 3/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
NPC1 O15118 1/20 0.58
BLM P54132 1/20 0.56
WRN Q14191 1/20 0.56
HPN P05981 1/20 0.56
PTPRE P23469 1/20 0.56
ALDH1A1 P00352 4/20 0.55
HPGD P15428 3/20 0.55
HSD17B10 Q99714 2/20 0.55
ALOX15 P16050 1/20 0.55
HTT P42858 3/20 0.54
ATM Q13315 1/20 0.54
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
LMNA P02545 3/20 0.52
GAA P10253 1/20 0.52
PAX8 Q06710 1/20 0.52
POLB P06746 1/20 0.52

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
SCHEMBL5450981 0.86 MAPT (0.59) MAPTRAB9ASMN1; SMN2NPC1BLM
SCHEMBL5442348 0.85 HPN (0.64) MAPTRAB9ASMN1; SMN2NPC1HPN
SCHEMBL5435707 0.82 HPN (0.62) MAPTRAB9ASMN1; SMN2NPC1HPN
SCHEMBL2181677 0.80 RAB9A (0.69) MAPTRAB9ASMN1; SMN2NPC1HPN
SCHEMBL5447957 0.80 MAPT (0.56) MAPTRAB9ANPC1BLMHPN
SCHEMBL5444646 0.77 BLM (0.74) MAPTSMN1; SMN2BLMWRNHTT
SCHEMBL244007 0.76 PTPRE (0.65) MAPTRAB9ASMN1; SMN2NPC1HPN
SCHEMBL3468124 0.76 MAPT (0.57) MAPTRAB9ASMN1; SMN2NPC1BLM
SCHEMBL5446510 0.75 KMT2A (0.75) RAB9ANPC1BLMWRNATM
SCHEMBL3466740 0.74 NPC1 (0.52) MAPTRAB9ASMN1; SMN2NPC1PTPRE

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-20070191353-A1 Use of thiadiazoleurea derivatives MERCK PATENT GMBH (DE) 2007-08-16 US claimed
US-20070191353-A1 Use of thiadiazoleurea derivatives MERCK PATENT GMBH (DE) 2007-08-16 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-20070191353-A1 Use of thiadiazoleurea derivatives RAF1, ARAF, JAK1 MAPT 3983/4885RAB9A 1942/4885SMN1; SMN2 3543/4885

“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.