SCHEMBL3166350

SCHEMBL3166350

O=CC1(NC(=O)Cc2ccc(Cl)cc2)CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.51
▸ LMNA P02545 2/20 0.48
▸ HSD11B1 P28845 1/20 0.45
▸ ALDH1A1 P00352 3/20 0.44
▸ HTT P42858 2/20 0.44
▸ ADRB2 P07550 1/20 0.44
▸ CNR2 P34972 1/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ GRM7 Q14831 1/20 0.43
▸ EGFR P00533 1/20 0.42
▸ ERBB2 P04626 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ NPC1 O15118 3/20 0.42
▸ RAB9A P51151 3/20 0.42
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ KCNQ2 O43526 1/20 0.40
▸ HDAC4 P56524 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
SCHEMBL3172394 0.82 EPHX2 (0.54) LMNAALDH1A1HTTSMN1; SMN2GAA
SCHEMBL3183655 0.78 ALDH1A1 (0.54) POLBLMNAHSD11B1ALDH1A1HTT
SCHEMBL23130338 0.68 POLB (1.00) POLBLMNAALDH1A1GAAGRM7
SCHEMBL20882878 0.67 TSHR (0.43) LMNAALDH1A1HTTSMN1; SMN2MAPT
SCHEMBL11688161 0.67 — —
SCHEMBL6184682 0.67 MEN1 (0.63) POLBLMNAALDH1A1HTTCNR2
SCHEMBL6244676 0.66 LMNA (0.59) POLBLMNAALDH1A1HTTCNR2
SCHEMBL965837 0.66 LMNA (0.59) POLBLMNAALDH1A1HTTCNR2
SCHEMBL6244680 0.66 POLB (0.67) POLBLMNAALDH1A1HTTCNR2
SCHEMBL21715626 0.65 MMP1 (0.42) —

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100016399-A1 GLYT1 Transporter Inhibitors and Uses Thereof in Treatment of Neurological and Neuropsychiatric Disorders AHMAD NADIA MAMOONA 2010-01-21 — — US disclosed
US-20100016399-A1 GLYT1 Transporter Inhibitors and Uses Thereof in Treatment of Neurological and Neuropsychiatric Disorders AHMAD NADIA MAMOONA 2010-01-21 — — US disclosed
WO-2008092873-A1 GLYT1 TRANSPORTER INHIBITORS AND USES THEREOF IN TREATMENT OF NEUROLOGICAL AND NEUROPSYCHIATRIC DISORDERS GLAXO GROUP LIMITED (GB) 2008-08-07 — — WO 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-20100016399-A1 GLYT1 Transporter Inhibitors and Uses Thereof in Treatment of Neurological and Neuropsychiatric Disorders SLC18A2, SLC1A2, SLC1A1 POLB 4384/4885LMNA 4812/4885HSD11B1 550/4885

“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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