SCHEMBL6476863

SCHEMBL6476863

CC(C)CCNc1c(-c2ccc(C(C)(C)C)cc2)cc(C(=O)C=Cc2ccc(C(=O)O)cc2)cc1C(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.51
MAPT P10636 2/20 0.51
TP53 P04637 2/20 0.51
CYP3A4 P08684 1/20 0.51
ALOX15 P16050 1/20 0.51
MAPK1 P28482 1/20 0.51
BLM P54132 1/20 0.51
CASP7 P55210 1/20 0.51
HSD17B10 Q99714 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
TNFRSF1A P19438 3/20 0.41
CSNK2A2 P19784 1/20 0.38
CSNK2B P67870 1/20 0.38
CSNK2A1 P68400 1/20 0.38
HPGD P15428 3/20 0.38
MEN1 O00255 1/20 0.38
MITF O75030 1/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
XDH P47989 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
SCHEMBL1406850 0.93 MAPT (0.46) SMN1; SMN2MAPTTP53CYP3A4ALOX15
SCHEMBL1406634 0.91 SMN1; SMN2 (0.53) SMN1; SMN2MAPTTP53CYP3A4ALOX15
SCHEMBL1406635 0.91 SMN1; SMN2 (0.53) SMN1; SMN2MAPTTP53CYP3A4ALOX15
SCHEMBL1406825 0.87 MAPT (0.50) SMN1; SMN2MAPTTP53CYP3A4ALOX15
SCHEMBL1407067 0.85 MAPT (0.52) SMN1; SMN2MAPTTP53CYP3A4ALOX15
SCHEMBL1407068 0.85 MAPT (0.52) SMN1; SMN2MAPTTP53CYP3A4ALOX15
SCHEMBL1406556 0.84 MAPT (0.47) SMN1; SMN2MAPTTP53CYP3A4ALOX15
SCHEMBL1406751 0.84 MAPT (0.47) SMN1; SMN2MAPTTP53CYP3A4ALOX15
SCHEMBL1406706 0.82 SMN1; SMN2 (0.53) SMN1; SMN2MAPTTP53CYP3A4ALOX15
SCHEMBL1406717 0.82 SMN1; SMN2 (0.53) SMN1; SMN2MAPTTP53CYP3A4ALOX15

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-20050131033-A1 Novel ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-06-16 US claimed

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-20050131033-A1 Novel ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof RARA, RARB, RARG SMN1; SMN2 4756/4885MAPT 4711/4885TP53 427/4885

“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.