SCHEMBL13113409

SCHEMBL13113409

Cn1ccc2ccc(N3Cc4ccc(-c5ccccc5)cc4C3=O)cc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 1/20 0.48
▸ TYRO3 Q06418 1/20 0.41
▸ NTRK2 Q16620 1/20 0.41
▸ CLK4 Q9HAZ1 1/20 0.41
▸ DYRK1B Q9Y463 1/20 0.41
▸ NPC1 O15118 4/20 0.41
▸ RAB9A P51151 4/20 0.41
▸ PKM P14618 3/20 0.40
▸ MAPKAPK2 P49137 1/20 0.39
▸ TP53 P04637 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ PGR P06401 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ NFKB1 P19838 1/20 0.37

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
SCHEMBL13113354 0.91 MCHR1 (0.48) MCHR1TYRO3NTRK2CLK4DYRK1B
SCHEMBL13113587 0.88 NPC1 (0.49) MCHR1NPC1RAB9APKMMAPKAPK2
SCHEMBL3481109 0.87 MAP3K5 (0.51) MCHR1MAPKAPK2CYP2C19CYP3A4HDAC6
SCHEMBL13113595 0.86 TNF (0.44) MCHR1MAPKAPK2MAP3K5PRMT5WDR77
SCHEMBL13113370 0.86 NPC1 (0.56) NPC1RAB9APKMTP53SMN1; SMN2
SCHEMBL13113458 0.83 PRKCI (0.43) NPC1RAB9APKMMAPKAPK2TP53
SCHEMBL13113450 0.83 NPC1 (0.47) MCHR1NPC1RAB9APKMTP53
SCHEMBL13113755 0.83 MCHR1 (0.48) MCHR1TYRO3NTRK2CLK4DYRK1B
SCHEMBL3481461 0.82 BACE1 (0.38) NPC1RAB9APKMTP53SMN1; SMN2
SCHEMBL13113424 0.82 HTR2C (0.48) MCHR1NPC1RAB9APKM

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 MCHR1 2055/4885TYRO3 4860/4885NTRK2 605/4885

“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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