SCHEMBL10144062

SCHEMBL10144062

CCCc1cc(=O)oc2cc(C)cc(OCC=C(C)C)c12

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.71
▸ KDM4E B2RXH2 8/20 0.71
▸ HSD17B10 Q99714 5/20 0.71
▸ HPGD P15428 5/20 0.71
▸ HTT P42858 2/20 0.58
▸ KMT2A Q03164 4/20 0.55
▸ LMNA P02545 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ RAB9A P51151 2/20 0.55
▸ ALOX15 P16050 1/20 0.54
▸ MEN1 O00255 2/20 0.53
▸ NPC1 O15118 1/20 0.50

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
SCHEMBL13166615 0.92 KDM4E (0.73) ALDH1A1KDM4EHSD17B10HPGDHTT
SCHEMBL26491609 0.76 KDM4E (0.72) ALDH1A1KDM4EHSD17B10HPGDKMT2A
SCHEMBL26491606 0.74 KDM4E (0.69) ALDH1A1KDM4EHSD17B10HPGDKMT2A
SCHEMBL13261899 0.66 ALDH1A1 (0.65) ALDH1A1KDM4EHSD17B10HPGDHTT
Prenyletin SCHEMBL30383964 0.65 ALDH1A1 (1.00) ALDH1A1KDM4EHSD17B10HPGDKMT2A
Prenyletin SCHEMBL12062090 0.65 ALDH1A1 (1.00) ALDH1A1KDM4EHSD17B10HPGDKMT2A
SCHEMBL31152138 0.65 ALDH1A1 (0.83) ALDH1A1KDM4EHSD17B10HPGDHTT
SCHEMBL3775925 0.65 ALDH1A1 (0.83) ALDH1A1KDM4EHSD17B10HPGDHTT
SCHEMBL6631881 0.65 ALDH1A1 (0.49) ALDH1A1KDM4EHSD17B10HPGDHTT
SCHEMBL19354014 0.64 KDM4E (0.52) ALDH1A1KDM4EHSD17B10HPGDHTT

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-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS BIOMARIN PHARMACEUTICAL INC. 2012-04-26 — — 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-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS ENGASE, GALNT1, GALNT13 ALDH1A1 2125/4885KDM4E 3708/4885HSD17B10 783/4885

“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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