SCHEMBL21202106

SCHEMBL21202106

CC[n+]1ccc(-c2ccc(-c3cc[n+](Cc4c(C)cc(C)cc4C)cc3C)cc2)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ RAB9A P51151 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ XDH P47989 1/20 0.34
▸ CHRNA7 P36544 4/20 0.33
▸ CHRNA10 Q9GZZ6 4/20 0.33
▸ CHRNA9 Q9UGM1 4/20 0.33
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30

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
SCHEMBL19601077 0.78 CHRNA7 (0.37) MEN1NPC1KMT2ARAB9ALMNA
SCHEMBL21202127 0.72 CHRNA7 (0.43) NPC1RAB9ALMNAHTTSMN1; SMN2
SCHEMBL19601091 0.71 ALDH1A1 (0.55) RAB9ALMNAHTTSMN1; SMN2KDM4E
SCHEMBL19601099 0.70 BCHE (0.39) —
SCHEMBL19601104 0.67 ALDH1A1 (0.58) RAB9ALMNAHTTSMN1; SMN2KDM4E
SCHEMBL21202131 0.67 ACHE (0.47) RAB9ALMNAHTTSMN1; SMN2KDM4E
SCHEMBL5295848 0.66 CHRNA7 (0.50) MEN1NPC1KMT2ARAB9ALMNA
SCHEMBL19601084 0.66 MEN1 (0.44) MEN1NPC1KMT2ARAB9ALMNA
SCHEMBL27254225 0.65 HDAC8 (0.42) MEN1NPC1KMT2ARAB9AXDH
SCHEMBL19601103 0.65 KDM4A (0.43) RAB9ACHRNA7CHRNA10CHRNA9KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10364223-B2 Organic compound, electrochromic element, optical filter, lens unit, image pickup apparatus, and window member CANON KABUSHIKI KAISHA (JP) 2019-07-30 — — 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-10364223-B2 Organic compound, electrochromic element, optical filter, lens unit, image pickup apparatus, and window member EML4, AP2M1, AP2A2 MEN1 1520/4885NPC1 1836/4885KMT2A 3416/4885

“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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