SCHEMBL5152025

SCHEMBL5152025

COCCn1cc(C[C@H](N)CO)c2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 3/20 0.51
▸ CNR2 P34972 5/20 0.47
▸ CNR1 P21554 4/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ KMT2A Q03164 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ HDAC10 Q969S8 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ REN P00797 1/20 0.41

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
SCHEMBL5154580 0.83 ICMT (0.55) SCN9ACNR2CNR1KMT2AALDH1A1
SCHEMBL5151526 0.83 SCN9A (0.49) SCN9AKMT2AALDH1A1MAPTRECQL
SCHEMBL5149260 0.82 SCN9A (0.53) SCN9AKMT2AALDH1A1MAPTRECQL
SCHEMBL4613529 0.82 SCN9A (0.53) SCN9AKMT2AALDH1A1MAPTRECQL
SCHEMBL5156070 0.82 SCN9A (0.53) SCN9AKMT2AALDH1A1MAPTRECQL
SCHEMBL5151102 0.81 SCN9A (0.57) SCN9AALDH1A1MAPT
SCHEMBL5155704 0.81 ICMT (0.62) SCN9ACNR2CNR1
SCHEMBL5154481 0.81 ICMT (0.62) SCN9ACNR2CNR1
SCHEMBL5151092 0.80 USP2 (0.51) SCN9ACNR2KMT2AALDH1A1MAPT
SCHEMBL1661389 0.79 GPR84 (0.57) SCN9AALDH1A1MAPTRECQL

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-20070060573-A1 Acyltryptophanols BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-03-15 — — 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 (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-20070060573-A1 Acyltryptophanols FSHR, NPY1R, NPY2R SCN9A 3913/4885CNR2 127/4885CNR1 168/4885

“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.

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