SCHEMBL26005287

SCHEMBL26005287

CCNC(=O)c1sc(-c2ccc(Br)cc2)nc1C

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.76
HPGD P15428 3/20 0.76
MAPT P10636 6/20 0.60
POLB P06746 2/20 0.60
GAA P10253 4/20 0.56
SMN1; SMN2 Q16637 5/20 0.56
ALDH1A1 P00352 5/20 0.56
NPSR1 Q6W5P4 1/20 0.55
RAB9A P51151 5/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
NFKB1 P19838 1/20 0.52
NFKB2 Q00653 1/20 0.52
RELA Q04206 1/20 0.52
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
KDM4E B2RXH2 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL24303682 0.82 NPC1 (0.52) NPC1HPGDMAPTPOLBGAA
SCHEMBL298961 0.80 NPC1 (0.62) NPC1HPGDMAPTPOLBGAA
SCHEMBL8339818 0.80 RAB9A (0.77) NPC1HPGDMAPTPOLBGAA
SCHEMBL28836099 0.80 RAB9A (0.72) NPC1HPGDMAPTPOLBGAA
SCHEMBL4464882 0.80 CDC7 (0.73) NPC1MAPTPOLBSMN1; SMN2ALDH1A1
SCHEMBL8345120 0.79 MAPT (0.57) NPC1HPGDMAPTPOLBGAA
SCHEMBL11398081 0.78 CYP1A2 (0.77) NPC1HPGDMAPTGAASMN1; SMN2
SCHEMBL6583153 0.76 PPARA (0.69) PPARA
SCHEMBL6582958 0.76 PPARA (0.85) PPARA
SCHEMBL7468338 0.75 PPARA (0.80) PPARA

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-20230265068-A1 TRANSIENT RECEPTOR POTENTIAL CANONICAL 3 INHIBITORS AND METHODS OF USE THEREOF UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2023-08-24 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-20230265068-A1 TRANSIENT RECEPTOR POTENTIAL CANONICAL 3 INHIBITORS AND METHODS OF USE THEREOF TRPC3, TRPV3, TRPV1 NPC1 700/4885HPGD 2586/4885MAPT 2823/4885

“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.