SCHEMBL13113391

SCHEMBL13113391

Cn1ccc2cc(N3Cc4ccc(Cl)cc4C3=O)ccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 5/20 0.48
▸ CBLB Q13191 2/20 0.46
▸ HTR2A P28223 2/20 0.46
▸ CYP11B1 P15538 1/20 0.39
▸ CYP11B2 P19099 1/20 0.39
▸ PRKCI P41743 1/20 0.39
▸ NPC1 O15118 3/20 0.37
▸ RAB9A P51151 3/20 0.37
▸ PKM P14618 2/20 0.37
▸ CYP19A1 P11511 1/20 0.37
▸ PTGES O14684 1/20 0.37
▸ CYP2A6 P11509 1/20 0.37
▸ MAOB P27338 1/20 0.36
▸ HTR2B P41595 2/20 0.34
▸ HSP90AA1 P07900 1/20 0.34
▸ HSP90AB1 P08238 1/20 0.34
▸ HSP90B1 P14625 1/20 0.34
▸ TRAP1 Q12931 1/20 0.34
▸ DRD3 P35462 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34

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
SCHEMBL13113393 0.90 CYP11B2 (0.50) HTR2CCBLBHTR2ACYP11B1CYP11B2
SCHEMBL13113424 0.90 HTR2C (0.48) HTR2CCBLBHTR2ACYP11B1CYP11B2
SCHEMBL13113452 0.86 NPC1 (0.47) HTR2CCBLBHTR2APRKCINPC1
SCHEMBL3481150 0.86 PRKCI (0.54) HTR2CCBLBPRKCINPC1RAB9A
SCHEMBL3481171 0.85 PRKCI (0.39) HTR2CCBLBHTR2APRKCINPC1
SCHEMBL13113529 0.85 PRKCI (0.39) HTR2CPRKCINPC1RAB9APKM
SCHEMBL3481223 0.85 PRKCI (0.39) HTR2CPRKCINPC1RAB9APKM
SCHEMBL13872217 0.85 PRKCI (0.39) HTR2CCBLBHTR2APRKCICYP19A1
SCHEMBL15478782 0.85 PRKCI (0.39) HTR2CCBLBHTR2APRKCINPC1
SCHEMBL13113771 0.85 CBLB (0.44) HTR2CCBLBHTR2ACYP11B1CYP11B2

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 HTR2C 2186/4885CBLB 4425/4885HTR2A 1105/4885

“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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