SCHEMBL13113569

SCHEMBL13113569

Cn1ccc2cc(N3Cc4ccc(-c5cccnc5)cc4C3=O)ccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP3K5 Q99683 3/20 0.51
▸ CYP11B2 P19099 7/20 0.45
▸ CYP11B1 P15538 6/20 0.45
▸ TDP2 O95551 2/20 0.41
▸ CYP1A2 P05177 3/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ HTR2B P41595 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ CYP17A1 P05093 1/20 0.40
▸ CYP19A1 P11511 1/20 0.40
▸ FAAH O00519 2/20 0.40
▸ HTR2C P28335 1/20 0.40

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
SCHEMBL3481109 0.92 MAP3K5 (0.51) MAP3K5CYP11B2CYP11B1TDP2CYP1A2
SCHEMBL13113578 0.89 TNF (0.44) MAP3K5FAAHLRRK2MCHR1
SCHEMBL13872207 0.88 CYP11B1 (0.43) MAP3K5CYP11B2CYP11B1TDP2CYP1A2
SCHEMBL13113354 0.87 MCHR1 (0.48) MAP3K5MEN1TP53CYP3A4CYP2D6
SCHEMBL13113767 0.83 MAP3K5 (0.54) MAP3K5CYP11B2CYP11B1TDP2CYP1A2
SCHEMBL13113595 0.81 TNF (0.44) MAP3K5CYP11B2LRRK2MCHR1
SCHEMBL13113563 0.81 NPC1 (0.49) KDM4EMEN1RECQLKMT2ATDP1
SCHEMBL13113409 0.79 MCHR1 (0.48) MAP3K5MEN1TP53CYP3A4CYP2D6
SCHEMBL13871907 0.79 MAP3K5 (0.49) MAP3K5CYP11B2CYP11B1TDP2CYP1A2
SCHEMBL13113452 0.78 NPC1 (0.47) KDM4ETP53HTR2BHTR2CMCHR1

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 MAP3K5 4170/4885CYP11B2 2631/4885CYP11B1 3034/4885

“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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