SCHEMBL2857757

SCHEMBL2857757

CCOCOc1ccc(CC)c(-c2ccc(C(=O)CC)cc2CC)c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.39
MAPT P10636 5/20 0.38
RAB9A P51151 4/20 0.38
NPC1 O15118 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 3/20 0.37
HTT P42858 2/20 0.37
GAA P10253 1/20 0.37
THRA P10827 1/20 0.36
PARP10 Q53GL7 1/20 0.36
TP53 P04637 1/20 0.36
MAPK1 P28482 1/20 0.36
HPGD P15428 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ABCB1 P08183 1/20 0.36

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
SCHEMBL2856534 0.93 VDR (0.42) SRD5A2MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL2863756 0.87 SRD5A2 (0.38) SRD5A2MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL13604875 0.82 VDR (0.45) SRD5A2MAPTNPC1SMN1; SMN2MEN1
SCHEMBL2853381 0.78 VDR (0.58) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL1022002 0.76 MTNR1A (0.44) MEN1KMT2AALDH1A1HPGD
SCHEMBL2856601 0.76 ALDH1A1 (0.46) MAPTSMN1; SMN2ALDH1A1HTTHPGD
SCHEMBL2852532 0.72 SMN1; SMN2 (0.48) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL2863404 0.72 VDR (0.68) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL10886320 0.69 ALDH1A1 (0.53) MAPTRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL1022007 0.69 ALDH1A1 (0.42) ALDH1A1HTTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1456160-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2010-01-20 EP disclosed
US-6924400-B2 Triaromatic vitamin D analogues GALDERMA RESEARCH & DEVELOPMENT, SNC (FR) 2005-08-02 US disclosed
EP-1456160-A2 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2004-09-15 EP disclosed
US-20030195259-A1 Triaromatic vitamin D analogues GALDERMA RESEARCH & DEVELOPMENT (FR) 2003-10-16 US disclosed
WO-2003050067-A2 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, SNC (FR) 2003-06-19 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-20030195259-A1 Triaromatic vitamin D analogues CYP24A1, CYP2R1, VDR SRD5A2 18/4885MAPT 3392/4885RAB9A 3535/4885

“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.