SCHEMBL10279956

SCHEMBL10279956

C=C1c2cc(OC)ccc2OC2(C)CCCO[C@H]12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPIB P23284 1/20 0.38
KDM4E B2RXH2 4/20 0.36
KLK7 P49862 1/20 0.36
MALT1 Q9UDY8 2/20 0.34
ALDH1A1 P00352 3/20 0.33
MAPT P10636 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
ABCB1 P08183 1/20 0.33
AR P10275 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
PGR P06401 1/20 0.32
HTR2B P41595 2/20 0.32
SIGMAR1 Q99720 2/20 0.32
HTR1A P08908 1/20 0.32
CYP19A1 P11511 1/20 0.32
METAP1 P53582 1/20 0.32
GAA P10253 2/20 0.32
HPGD P15428 2/20 0.32

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
SCHEMBL8512844 1.00 PPIB (0.38) PPIBKDM4EKLK7MALT1ALDH1A1
SCHEMBL8512845 1.00 PPIB (0.38) PPIBKDM4EKLK7MALT1ALDH1A1
SCHEMBL8515318 0.85 PPIB (0.43) PPIBKDM4EKLK7MALT1ALDH1A1
SCHEMBL12490443 0.85 PPIB (0.43) PPIBKDM4EKLK7MALT1ALDH1A1
SCHEMBL8515320 0.85 PPIB (0.43) PPIBKDM4EKLK7MALT1ALDH1A1
SCHEMBL12489864 0.68 PBRM1 (0.38) KDM4EMALT1MAPTCYP19A1SMN1; SMN2
SCHEMBL7630550 0.62 PPIB (0.44) PPIBKDM4EKLK7MALT1ALDH1A1
SCHEMBL7630543 0.62 PPIB (0.44) PPIBKDM4EKLK7MALT1ALDH1A1
SCHEMBL7630554 0.62 PPIB (0.44) PPIBKDM4EKLK7MALT1ALDH1A1
SCHEMBL6086511 0.61 KDM4E (0.65) PPIBKDM4EKLK7ALDH1A1MAPT

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-20120157448-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES GENENTECH, INC. 2012-06-21 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-20120157448-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES BACE1, PSEN1, PSEN2 PPIB 621/4885KDM4E 3940/4885KLK7 4564/4885

“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.