SCHEMBL13302161

SCHEMBL13302161

Cc1ccc2[nH]cc(-c3c(C)c(C)cc4ccccc34)c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.43
▸ MEN1 O00255 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ NPC1 O15118 3/20 0.43
▸ ATM Q13315 2/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ PCSK9 Q8NBP7 1/20 0.43
▸ MAOA P21397 1/20 0.41
▸ MAOB P27338 1/20 0.41
▸ SLC6A4 P31645 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ GPR55 Q9Y2T6 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
SCHEMBL13302155 0.88 MAPT (0.51) MAPTMEN1KMT2ANPC1ATM
SCHEMBL13302154 0.82 PTPN1 (0.49) MAPTMEN1KMT2ANPC1KDM4E
SCHEMBL9754886 0.79 HTR1D (0.47) MAPTMEN1KMT2ANPC1KDM4E
SCHEMBL18392203 0.75 MEN1 (0.54) MAPTMEN1KMT2ANPC1ATM
SCHEMBL13302165 0.74 DYRK1A (0.56) —
SCHEMBL31001028 0.73 CYP1A2 (0.52) MAPTATMKDM4EALDH1A1CYP1A2
SCHEMBL12135116 0.72 PIM1 (0.51) MAPTMEN1KMT2ANPC1KDM4E
SCHEMBL17178926 0.72 AR (0.66) MAPTMEN1KMT2ANPC1ATM
SCHEMBL13302160 0.71 HTT (0.44) MAPTKDM4ESMN1; SMN2ALDH1A1AR
SCHEMBL5178631 0.71 ALDH1A1 (0.47) KDM4EMAOAMAOBALDH1A1CYP1A2

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-8362066-B2 Compounds and methods for treating protein folding disorders TREVENTIS CORPORATION (US) 2013-01-29 — — US disclosed
US-20100144821-A1 COMPOUNDS AND METHODS FOR TREATING PROTEIN FOLDING DISORDERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2010-06-10 — — 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-20100144821-A1 COMPOUNDS AND METHODS FOR TREATING PROTEIN FOLDING DISORDERS SNCA, MAPT, APP MAPT 2/4885MEN1 3370/4885KMT2A 3262/4885

“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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