SCHEMBL15230776

SCHEMBL15230776

CCN1CCCN(c2ccc3cc(-c4cn5cccc(Cl)c5n4)c(=O)oc3n2)CC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.40
ALDH1A1 P00352 2/20 0.40
RAB9A P51151 2/20 0.40
KDM4E B2RXH2 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CASP1 P29466 1/20 0.37
HRH3 Q9Y5N1 1/20 0.36
CNR2 P34972 2/20 0.35
SUV39H2 Q9H5I1 10/20 0.34
CNR1 P21554 1/20 0.34
MAOB P27338 1/20 0.34
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
DRD2 P14416 2/20 0.33
DRD3 P35462 2/20 0.33
PDE10A Q9Y233 1/20 0.32

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
SCHEMBL16782257 0.97 NPC1 (0.43) NPC1ALDH1A1RAB9AKDM4EL3MBTL1
SCHEMBL16782248 0.90 ALDH1A1 (0.40) NPC1ALDH1A1RAB9AKDM4EL3MBTL1
SCHEMBL15230839 0.89 NPC1 (0.42) NPC1ALDH1A1RAB9AKDM4EL3MBTL1
SCHEMBL16782185 0.87 ALDH1A1 (0.45) NPC1ALDH1A1RAB9AKDM4EL3MBTL1
SCHEMBL16782254 0.86 ALDH1A1 (0.43) NPC1ALDH1A1RAB9AKDM4EL3MBTL1
SCHEMBL15243891 0.85 ALDH1A1 (0.49) NPC1ALDH1A1RAB9AKDM4EL3MBTL1
SCHEMBL15243886 0.85 HRH3 (0.35) NPC1ALDH1A1RAB9AKDM4EL3MBTL1
SCHEMBL16782192 0.84 KDM4E (0.50) NPC1ALDH1A1RAB9AKDM4EL3MBTL1
SCHEMBL15231098 0.84 ALDH1A1 (0.42) NPC1ALDH1A1RAB9AKDM4EL3MBTL1
SCHEMBL21515360 0.84 NPC1 (0.39) NPC1ALDH1A1RAB9AKDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2819519-B1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC THERAPEUTICS INC (US) 2019-10-23 EP claimed
US-9371336-B2 Compounds for treating spinal muscular atrophy PTC THERAPEUTICS, INC. (US) 2016-06-21 US claimed
US-20150166575-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC THERAPEUTICS INC. (US) 2015-06-18 US claimed
EP-2819519-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC Therapeutics, Inc. (US) 2015-01-07 EP claimed
WO-2013130689-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC THERAPEUTICS, INC. (US) 2013-09-06 WO claimed
EP-2819519-B1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC THERAPEUTICS INC (US) 2019-10-23 EP disclosed
US-9371336-B2 Compounds for treating spinal muscular atrophy PTC THERAPEUTICS, INC. (US) 2016-06-21 US disclosed
US-9371336-B2 Compounds for treating spinal muscular atrophy PTC THERAPEUTICS, INC. (US) 2016-06-21 US disclosed
US-20150166575-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC THERAPEUTICS INC. (US) 2015-06-18 US disclosed
US-20150166575-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC THERAPEUTICS INC. (US) 2015-06-18 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-20150166575-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY SMN1; SMN2, CPT1B, GYS1 NPC1 975/4885ALDH1A1 1461/4885RAB9A 1728/4885

“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.