SCHEMBL19627243

SCHEMBL19627243

Cc1ccc2nc(NC(=O)c3cc(Cl)ccc3O)sc2c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.63
RAB9A P51151 7/20 0.63
MEN1 O00255 4/20 0.63
KMT2A Q03164 4/20 0.63
KDM4E B2RXH2 4/20 0.63
SMN1; SMN2 Q16637 3/20 0.63
ALDH1A1 P00352 2/20 0.63
NFKB1 P19838 2/20 0.63
NFKB2 Q00653 2/20 0.63
RELA Q04206 2/20 0.63
HPGD P15428 1/20 0.63
CASP3 P42574 4/20 0.60
SENP7 Q9BQF6 4/20 0.60
MAPT P10636 4/20 0.60
DYRK1A Q13627 2/20 0.60
OPRK1 P41145 1/20 0.60
HTT P42858 1/20 0.60
FSCN1 Q16658 1/20 0.58
GAA P10253 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58

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
SCHEMBL19627239 0.91 DYRK1A (0.60) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL17770431 0.86 LRRK2 (0.71) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL19627279 0.85 NPC1 (0.61) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL19627212 0.85 NPC1 (0.61) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL13236116 0.84 NPC1 (0.76) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL17770342 0.84 DHODH (0.76) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL17770408 0.83 DYRK1A (0.61) NPC1RAB9AKDM4ESMN1; SMN2NFKB1
SCHEMBL30472744 0.83 CSNK1D (0.62) MEN1KMT2ADYRK1ACSNK1DMAP4K5
SCHEMBL17770389 0.83 CSNK1D (0.62) MEN1KMT2ADYRK1ACSNK1DMAP4K5
SCHEMBL19627233 0.83 MAPT (0.58) NPC1RAB9AMEN1KMT2AKDM4E

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-20170334869-A1 NOVEL MITOCHONDRIAL UNCOUPLERS FOR TREATMENT OF METABOLIC DISEASES AND CANCER RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2017-11-23 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-20170334869-A1 NOVEL MITOCHONDRIAL UNCOUPLERS FOR TREATMENT OF METABOLIC DISEASES AND CANCER AK2, PC, GLS2 NPC1 684/4885RAB9A 4019/4885MEN1 3692/4885

“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.