SCHEMBL23211151

SCHEMBL23211151

O=C(O)N(CCc1ccccc1)C1CCCNC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RPS6KB1 P23443 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MBTPS1 Q14703 6/20 0.47
KCNH2 Q12809 2/20 0.46
CHEK1 O14757 1/20 0.46
OPRM1 P35372 3/20 0.46
PKM P14618 1/20 0.46
CTSD P07339 1/20 0.45
SLC6A2 P23975 6/20 0.45
SLC6A4 P31645 6/20 0.45
SLC6A3 Q01959 5/20 0.45
CYP2D6 P10635 1/20 0.44
OPRD1 P41143 1/20 0.44
OPRK1 P41145 1/20 0.44

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
SCHEMBL5143426 0.87 CTSD (0.55) L3MBTL1KCNH2CTSDSLC6A2SLC6A4
SCHEMBL1623585 0.87 CTSD (0.55) L3MBTL1KCNH2CTSDSLC6A2SLC6A4
SCHEMBL2727813 0.87 CTSD (0.55) L3MBTL1KCNH2CTSDSLC6A2SLC6A4
SCHEMBL16527961 0.83 PYGL (0.46) RPS6KB1MBTPS1KCNH2CTSDSLC6A2
SCHEMBL27936852 0.82 CTSD (0.50) RPS6KB1KCNH2CTSDSLC6A2SLC6A4
SCHEMBL27936854 0.82 CTSD (0.50) RPS6KB1KCNH2CTSDSLC6A2SLC6A4
SCHEMBL21625220 0.80 SLC18A3 (0.50) RPS6KB1L3MBTL1OPRM1SLC6A2SLC6A4
SCHEMBL31016686 0.80 SLC18A3 (0.50) RPS6KB1L3MBTL1OPRM1SLC6A2SLC6A4
Hydrochloric Acid SCHEMBL29057102 0.79 SLC18A3 (0.49) RPS6KB1L3MBTL1OPRM1SLC6A2SLC6A4
SCHEMBL18342235 0.78 SLC6A2 (0.60) KCNH2CTSDSLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11623921-B2 Indole carboxamide compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2023-04-11 US disclosed
US-20210107891-A1 INDOLE CARBOXAMIDE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2021-04-15 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 (2 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-11623921-B2 Indole carboxamide compounds BTK, JAK2, BRD4 RPS6KB1 597/4885L3MBTL1 3589/4885MBTPS1 2752/4885
US-20210107891-A1 INDOLE CARBOXAMIDE COMPOUNDS BTK, JAK2, BRD4 RPS6KB1 597/4885L3MBTL1 3589/4885MBTPS1 2752/4885

“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.