SCHEMBL3068359

SCHEMBL3068359

CCC(=O)NCc1csc(N(C)c2ccccc2)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.52
RAB9A P51151 2/20 0.52
KDM4E B2RXH2 2/20 0.52
ADRB2 P07550 1/20 0.46
ADRB1 P08588 1/20 0.46
ADRB3 P13945 1/20 0.46
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
MAPT P10636 3/20 0.43
HPGD P15428 3/20 0.43
NPC1 O15118 2/20 0.43
USP2 O75604 1/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
NFKB1 P19838 1/20 0.43
MAPK1 P28482 1/20 0.43
MMP13 P45452 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL3058594 0.83 LMNA (0.48) LMNARAB9AKDM4EKMT2AMEN1
SCHEMBL11589491 0.80 HPGD (0.48) LMNARAB9AKDM4EADRB2ADRB1
SCHEMBL11590078 0.76 MEN1 (0.70) LMNARAB9AKDM4EKMT2AMEN1
SCHEMBL4734484 0.73 ADRB2 (0.43) LMNARAB9AADRB2ADRB1ADRB3
SCHEMBL4733657 0.72 CHEK1 (0.52) LMNARAB9AKDM4EKMT2AMEN1
SCHEMBL21229023 0.70 MEN1 (0.57) LMNARAB9AKDM4EKMT2AMEN1
SCHEMBL4739602 0.70 RAB9A (0.54) LMNARAB9AKDM4EKMT2AMEN1
SCHEMBL4735985 0.70 CHEK1 (0.53) LMNARAB9AKDM4EADRB2ADRB1
SCHEMBL13024418 0.69 LMNA (0.55) LMNARAB9AKDM4EKMT2AMEN1
SCHEMBL11589312 0.69 NPC1 (0.48) LMNARAB9AKDM4EADRB2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100267697-A1 ION CHANNEL MODULATORS WYETH (US) 2010-10-21 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-20100267697-A1 ION CHANNEL MODULATORS CACNA1E, CACNA1A, CACNA1S LMNA 2283/4885RAB9A 997/4885KDM4E 1978/4885

“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.