SCHEMBL3702286

SCHEMBL3702286

Cc1csc(C(=O)CCl)n1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 8/20 0.44
HSD17B10 Q99714 1/20 0.42
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
NOS1 P29475 1/20 0.38
PLA2G4A P47712 1/20 0.37
HDAC3 O15379 1/20 0.37
HDAC1 Q13547 1/20 0.37
RAB9A P51151 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
GAA P10253 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL4808785 0.85 HSD17B10 (0.42) GSK3BHSD17B10MAPTSMN1; SMN2NOS1
Bromide SCHEMBL6171884 0.83 HSD17B10 (0.41) GSK3BHSD17B10MAPTSMN1; SMN2NOS1
SCHEMBL6840495 0.82 HSD17B10 (0.43) HSD17B10MAPTSMN1; SMN2NOS1PLA2G4A
SCHEMBL15173866 0.79 RAB9A (0.41) HSD17B10MAPTSMN1; SMN2PLA2G4ARAB9A
SCHEMBL6840487 0.79 PLA2G4A (0.50) HSD17B10MAPTSMN1; SMN2NOS1PLA2G4A
SCHEMBL20769319 0.78 HSD17B10 (0.40) HSD17B10MAPTSMN1; SMN2NOS1PLA2G4A
SCHEMBL8007997 0.78
SCHEMBL27858618 0.77 HSD17B10 (0.48) HSD17B10MAPTSMN1; SMN2NOS1RAB9A
SCHEMBL15174136 0.77 HSD17B10 (0.39) HSD17B10MAPTSMN1; SMN2RAB9AKDM4E
SCHEMBL929092 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012064269-A1 COMPOUNDS AND THEIR USE FOR TREATMENT OF Αβ-RELATED DISEASES ASTRAZENECA AB (SE) 2012-05-18 WO disclosed
WO-2012064269-A1 COMPOUNDS AND THEIR USE FOR TREATMENT OF Αβ-RELATED DISEASES ASTRAZENECA AB (SE) 2012-05-18 WO disclosed
US-20120122843-A1 Compounds and Their Use for Treatment of Amyloid Beta-Related Diseases ASTRAZENECA AB (SE) 2012-05-17 US disclosed
US-20120122843-A1 Compounds and Their Use for Treatment of Amyloid Beta-Related Diseases ASTRAZENECA AB (SE) 2012-05-17 US disclosed
US-20120122843-A1 Compounds and Their Use for Treatment of Amyloid Beta-Related Diseases ASTRAZENECA AB (SE) 2012-05-17 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-20120122843-A1 Compounds and Their Use for Treatment of Amyloid Beta-Related Diseases APP, BACE1, PSEN1 GSK3B 152/4885HSD17B10 2068/4885MAPT 7/4885

“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.