SCHEMBL8512148

SCHEMBL8512148

COCOc1ccc(Br)cc1C/C=C(\C)CO

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
KMT2A Q03164 4/20 0.40
RAB9A P51151 3/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
CYP3A4 P08684 2/20 0.39
CYP2D6 P10635 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP19A1 P11511 2/20 0.37
HPGD P15428 2/20 0.36
NPC1 O15118 2/20 0.36
KDM4E B2RXH2 2/20 0.36
MAPK1 P28482 1/20 0.36
TSHR P16473 2/20 0.36
MEN1 O00255 3/20 0.36
HTT P42858 2/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL8512153 1.00 LMNA (0.40) LMNASMN1; SMN2KMT2ARAB9APTGDR2
SCHEMBL9932317 0.81 HPGD (0.39) LMNASMN1; SMN2KMT2ARAB9APTGDR2
SCHEMBL8513968 0.81 HPGD (0.39) LMNASMN1; SMN2KMT2ARAB9APTGDR2
SCHEMBL8515544 0.80 KMT2A (0.37) LMNASMN1; SMN2KMT2ARAB9APTGDR2
SCHEMBL8515543 0.80 KMT2A (0.37) LMNASMN1; SMN2KMT2ARAB9APTGDR2
SCHEMBL30152364 0.79 PTGDR2 (0.59) LMNASMN1; SMN2KMT2ARAB9APTGDR2
SCHEMBL8712221 0.79 PTGDR2 (0.59) LMNASMN1; SMN2KMT2ARAB9APTGDR2
SCHEMBL4014116 0.79 CYP3A4 (0.42) LMNASMN1; SMN2KMT2ARAB9APTGDR2
SCHEMBL5569933 0.75 PTGDR2 (0.45) LMNASMN1; SMN2KMT2ARAB9APTGDR2
SCHEMBL8712410 0.73 CCR5 (0.42) LMNASMN1; SMN2KMT2ARAB9APTGDR2

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-20120157448-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES GENENTECH, INC. 2012-06-21 US disclosed
WO-2012071458-A1 HETEROCYCLIC INHIBITORS OF BETA - SECRETASE FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES ARRAY BIOPHARMA INC. (US) 2012-05-31 WO 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 LMNA 616/4885SMN1; SMN2 54/4885KMT2A 4037/4885

“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.