SCHEMBL13302160

SCHEMBL13302160

Cc1cc2ccccc2c(-c2c[nH]c3c(C(=O)O)cccc23)c1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ AR P10275 4/20 0.43
▸ SOS1 Q07889 1/20 0.43
▸ CSNK2A2 P19784 1/20 0.42
▸ CSNK2B P67870 1/20 0.42
▸ CSNK2A1 P68400 1/20 0.42
▸ NR4A1 P22736 1/20 0.42
▸ NR4A2 P43354 1/20 0.42
▸ NR4A3 Q92570 1/20 0.42
▸ MYC P01106 1/20 0.41
▸ KEAP1 Q14145 1/20 0.41
▸ KDM4E B2RXH2 3/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ WDR5 P61964 1/20 0.40
▸ MAPT P10636 2/20 0.39
▸ PIM1 P11309 1/20 0.39
▸ GFER P55789 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL13302415 0.81 SOS1 (0.44) HTTSMN1; SMN2SOS1CSNK2A2CSNK2B
SCHEMBL13302154 0.78 PTPN1 (0.49) SMN1; SMN2KDM4EALDH1A1HPGDMAPT
SCHEMBL13302155 0.76 MAPT (0.51) SMN1; SMN2NR4A2KDM4EALDH1A1MAPT
SCHEMBL5429949 0.73 PBRM1 (0.51) HTTSMN1; SMN2NR4A2KDM4EALDH1A1
SCHEMBL13302169 0.72 SMN1; SMN2 (0.44) HTTSMN1; SMN2ARCSNK2A2CSNK2B
SCHEMBL13302188 0.72 KDM5A (0.49) HTTSMN1; SMN2CSNK2A2CSNK2BCSNK2A1
SCHEMBL13302186 0.72 CA12 (0.46) HTTSMN1; SMN2SOS1CSNK2A2CSNK2B
SCHEMBL11871562 0.72 CSNK2A2 (0.41) HTTSMN1; SMN2SOS1CSNK2A2CSNK2B
SCHEMBL13302161 0.71 MAPT (0.43) HTTSMN1; SMN2ARKDM4EALDH1A1
SCHEMBL2811213 0.71 HTT (0.59) HTTSMN1; SMN2CSNK2A2CSNK2BCSNK2A1

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 HTT 5/4885SMN1; SMN2 141/4885AR 3324/4885

“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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