SCHEMBL2483241

SCHEMBL2483241

COc1ccc(C(=O)Nc2nc3ccc(C)cc3s2)cc1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCD O00767 15/20 0.84
NPC1 O15118 4/20 0.84
RAB9A P51151 4/20 0.84
MEN1 O00255 3/20 0.84
KMT2A Q03164 3/20 0.84
MAP3K5 Q99683 1/20 0.72
KDM4E B2RXH2 3/20 0.72
NPSR1 Q6W5P4 2/20 0.72
ALDH1A1 P00352 2/20 0.72
RXFP1 Q9HBX9 1/20 0.72
CASP3 P42574 1/20 0.71
SENP8 Q96LD8 1/20 0.71
SENP7 Q9BQF6 1/20 0.71
SENP6 Q9GZR1 1/20 0.71
HPGD P15428 2/20 0.67
PPARG P37231 1/20 0.67
PTK2B Q14289 1/20 0.67
NCOA2 Q15596 1/20 0.67
NCOA1 Q15788 1/20 0.67
NR2E3 Q9Y5X4 1/20 0.67

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
SCHEMBL12199492 0.93 SCD (0.73) SCDNPC1RAB9AMEN1KMT2A
SCHEMBL4913650 0.93 SCD (0.88) SCDNPC1RAB9AMEN1KMT2A
Bromide SCHEMBL2485614 0.92 SCD (0.72) SCDNPC1RAB9AMEN1KMT2A
SCHEMBL31243 0.91 SCD (1.00) SCDNPC1RAB9AMEN1KMT2A
SCHEMBL13329390 0.90 MAP3K5 (0.83) SCDNPC1RAB9AMEN1KMT2A
SCHEMBL2753553 0.88 SCD (0.93) SCDNPC1RAB9AMEN1KMT2A
SCHEMBL31055 0.88 SCD (0.84) SCDNPC1RAB9AMEN1KMT2A
SCHEMBL21376791 0.87 SCD (0.64) SCDNPC1RAB9AMEN1KMT2A
SCHEMBL16742048 0.87 SCD (0.85) SCDNPC1RAB9AMEN1KMT2A
SCHEMBL31219331 0.87 SCD (0.87) SCDNPC1RAB9AMEN1KMT2A

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
EP-2376463-A1 BENZOTHIAZOLE AMIDES FOR DETECTION OF AMYLOID BETA Bayer Pharma Aktiengesellschaft (DE) 2011-10-19 EP disclosed
US-20110243846-A1 BENZOTHIAZOLE AMIDES FOR DETECTION OF AMYLOID BETA BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-10-06 US disclosed
WO-2010066357-A1 BENZOTHIAZOLE AMIDES FOR DETECTION OF AMYLOID BETA BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-06-17 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-20110243846-A1 BENZOTHIAZOLE AMIDES FOR DETECTION OF AMYLOID BETA APP, APBA1, BACE1 SCD 2053/4885NPC1 473/4885RAB9A 2966/4885

“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.