SCHEMBL13113370

SCHEMBL13113370

Cn1ccc2ccc(N3Cc4ccccc4C3=O)cc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 5/20 0.56
▸ RAB9A P51151 5/20 0.56
▸ PKM P14618 3/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ TP53 P04637 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ NFKB1 P19838 2/20 0.47
▸ NFKB2 Q00653 2/20 0.47
▸ RELA Q04206 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ PGR P06401 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ DRD1 P21728 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ HDAC6 Q9UBN7 1/20 0.47
▸ CYP11B2 P19099 1/20 0.46

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
SCHEMBL13113353 0.90 NPC1 (0.56) NPC1RAB9APKMSMN1; SMN2TP53
SCHEMBL13113409 0.86 MCHR1 (0.48) NPC1RAB9APKMSMN1; SMN2TP53
SCHEMBL13113445 0.85 PRKCI (0.43) NPC1RAB9APKMKMT2AMEN1
SCHEMBL13113450 0.85 NPC1 (0.47) NPC1RAB9APKMSMN1; SMN2TP53
SCHEMBL13113369 0.85 NPC1 (0.47) NPC1RAB9APKMSMN1; SMN2TP53
SCHEMBL13113458 0.85 PRKCI (0.43) NPC1RAB9APKMSMN1; SMN2TP53
SCHEMBL3481461 0.84 BACE1 (0.38) NPC1RAB9APKMSMN1; SMN2TP53
SCHEMBL13113338 0.84 BACE1 (0.44) NPC1RAB9APKMCYP11B2HTR2C
SCHEMBL13113424 0.84 HTR2C (0.48) NPC1RAB9APKMCYP11B2HTR2C
SCHEMBL13113707 0.84 NPC1 (0.37) NPC1RAB9APKMSMN1; SMN2TP53

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-20100267712-A1 ISOINDOLINE COMPOUNDS FOR THE TREATMENT OF SPINAL MUSCULAR ATROPHY AND OTHER USES The United States of America, as represented by the Secretary, Department of Health and 2010-10-21 — — US disclosed
US-20100267712-A1 ISOINDOLINE COMPOUNDS FOR THE TREATMENT OF SPINAL MUSCULAR ATROPHY AND OTHER USES The United States of America, as represented by the Secretary, Department of Health and 2010-10-21 — — 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-20100267712-A1 ISOINDOLINE COMPOUNDS FOR THE TREATMENT OF SPINAL MUSCULAR ATROPHY AND OTHER USES SMN1; SMN2, SYNCRIP, RNMT NPC1 1441/4885RAB9A 985/4885PKM 2023/4885

“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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