SCHEMBL5043978

SCHEMBL5043978

CN(C)c1ccc(C(C)(C)Oc2cc(C(=O)/C=C/c3ccc(C(=O)O)cc3)cc3c2C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
TP53 P04637 2/20 0.45
CYP3A4 P08684 2/20 0.45
BLM P54132 2/20 0.45
HSD17B10 Q99714 2/20 0.45
ALOX15 P16050 1/20 0.45
MAPK1 P28482 1/20 0.45
CASP7 P55210 1/20 0.45
RARA P10276 5/20 0.43
RARB P10826 5/20 0.43
RARG P13631 5/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
KMT2A Q03164 3/20 0.43
CASP3 P42574 1/20 0.43
CYP1B1 Q16678 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43

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
SCHEMBL5043982 1.00 MAPT (0.45) MAPTSMN1; SMN2TDP1TP53CYP3A4
SCHEMBL5047272 0.90 MAPT (0.47) MAPTSMN1; SMN2TDP1TP53CYP3A4
SCHEMBL5047265 0.90 MAPT (0.47) MAPTSMN1; SMN2TDP1TP53CYP3A4
SCHEMBL5048367 0.89 SMN1; SMN2 (0.47) MAPTSMN1; SMN2TDP1TP53CYP3A4
SCHEMBL5048368 0.89 SMN1; SMN2 (0.47) MAPTSMN1; SMN2TDP1TP53CYP3A4
SCHEMBL5049651 0.84 MAPT (0.45) MAPTSMN1; SMN2TDP1TP53CYP3A4
SCHEMBL5049653 0.84 MAPT (0.45) MAPTSMN1; SMN2TDP1TP53CYP3A4
SCHEMBL5047245 0.84 RARB (0.55) SMN1; SMN2TP53CYP3A4BLMHSD17B10
SCHEMBL5047237 0.84 RARB (0.55) SMN1; SMN2TP53CYP3A4BLMHSD17B10
SCHEMBL5047242 0.84 RARB (0.55) SMN1; SMN2TP53CYP3A4BLMHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7326803-B2 Ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-02-05 US claimed
US-20050148670-A1 Novel ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-07-07 US claimed
US-7326803-B2 Ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-02-05 US disclosed
US-20050148670-A1 Novel ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-07-07 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-20050148670-A1 Novel ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof RARA, RARB, RARG MAPT 4731/4885SMN1; SMN2 4697/4885TDP1 3404/4885

“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.