SCHEMBL17150985

SCHEMBL17150985

N#Cc1ccccc1-c1csc(NN=C2CCCC2)n1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 18/20 0.63
MAOA P21397 17/20 0.63
KDM4E B2RXH2 2/20 0.55
MEN1 O00255 2/20 0.55
MAPT P10636 2/20 0.55
KMT2A Q03164 2/20 0.55
LMNA P02545 1/20 0.55
GAA P10253 1/20 0.55
MAPK1 P28482 1/20 0.55
NPC1 O15118 1/20 0.54
ALDH1A1 P00352 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL28689930 0.80 MAOB (0.74) MAOBMAOAKDM4EMEN1MAPT
SCHEMBL18998987 0.78 MAOA (1.00) MAOBMAOA
SCHEMBL17144586 0.78 MAOA (1.00) MAOBMAOA
SCHEMBL19017688 0.77 MAOA (1.00) MAOBMAOA
SCHEMBL17150990 0.77 MAOA (1.00) MAOBMAOA
Bromide SCHEMBL29420161 0.77 MAOA (0.97) MAOBMAOA
SCHEMBL17150982 0.76 MAOA (0.74) MAOBMAOA
SCHEMBL1916014 0.76 KMT2A (0.51) KDM4EMEN1MAPTKMT2AMAPK1
SCHEMBL17150981 0.70 MAOA (0.76) MAOBMAOAALDH1A1
SCHEMBL17144584 0.70 MAOA (1.00) MAOBMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9809562-B2 NAT10 modulators for treating or preventing laminopathies, aging and cancer CAMBRIDGE ENTERPRISE LIMITED (GB) 2017-11-07 US disclosed
US-20170174644-A1 NAT10 MODULATORS FOR TREATING OR PREVENTING LAMINOPATHIES, AGING AND CANCER CAMBRIDGE ENTERPRISE LIMITED (GB) 2017-06-22 US disclosed
WO-2015150824-A1 NAT10 MODULATORS FOR TREATING OR PREVENTING LAMINOPATHIES, AGING AND CANCER CAMBRIDGE ENTERPRISE LIMITED (GB) 2015-10-08 WO 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-20170174644-A1 NAT10 MODULATORS FOR TREATING OR PREVENTING LAMINOPATHIES, AGING AND CANCER LMNB2, LMNB1, LMNA MAOB 4229/4885MAOA 4114/4885KDM4E 2680/4885

“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.