SCHEMBL3756112

SCHEMBL3756112

CC1(C)CCC(C)(C)c2cc([C@H](O)C(=O)Nc3ccc(C(=O)O)cc3F)ccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 14/20 1.00
RARG P13631 14/20 1.00
CYP26A1 O43174 5/20 1.00
CYP3A4 P08684 4/20 1.00
RXRA P19793 7/20 0.57
RARA P10276 12/20 0.56
RXRB P28702 4/20 0.54
CYP26B1 Q9NR63 2/20 0.50
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
CYP2C19 P33261 1/20 0.47
PGR P06401 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
TBXA2R P21731 1/20 0.47
BLVRB P30043 1/20 0.47

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
SCHEMBL29354207 1.00 RARB (1.00) RARBRARGCYP26A1CYP3A4RXRA
SCHEMBL30477013 1.00 RARB (1.00) RARBRARGCYP26A1CYP3A4RXRA
SCHEMBL165751 1.00 RARB (1.00) RARBRARGCYP26A1CYP3A4RXRA
SCHEMBL165750 1.00 RARB (1.00) RARBRARGCYP26A1CYP3A4RXRA
SCHEMBL29613246 1.00 RARB (1.00) RARBRARGCYP26A1CYP3A4RXRA
SCHEMBL8519542 0.89 RARB (0.81) RARBRARGCYP26A1CYP3A4RXRA
SCHEMBL5080286 0.83 RARB (0.71) RARBRARGCYP26A1CYP3A4RXRA
SCHEMBL23752347 0.79 RARB (0.65) RARBRARGCYP26A1CYP3A4RXRA
SCHEMBL23752176 0.79 RARB (0.65) RARBRARGCYP26A1CYP3A4RXRA
SCHEMBL20609262 0.77 RARB (0.63) RARBRARGCYP26A1CYP3A4RXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100144683-A1 METHODS FOR GENERATING MAMMALIAN MODELS OF ATOPIC DISEASES, AND SCREENING FOR THEIR TREATMENT ASSOCIATION POUR LA RECHERCHE A L'IGBMC (ARI) (FR) 2010-06-10 US claimed
EP-1891944-A1 Use of Vitamin D3 agonist in a mammalian model for atopic diseases and of Vitamin D3 antagonists for the treatment of atopic diseases Association pour la recherche à l'IGBMC (ARI) (FR) 2008-02-27 EP claimed
US-10980778-B2 Methods for treating multiple osteochondroma (MO) Clementia Pharmaceuticals Inc. (CA) 2021-04-20 US disclosed
US-20190275005-A1 METHODS FOR TREATING MULTIPLE OSTEOCHONDROMA (MO) Clementia Pharmaceuticals Inc. (CA) 2019-09-12 US disclosed
WO-2018090137-A1 METHODS FOR TREATING MULTIPLE OSTEOCHONDROMA (MO) Clementia Pharmaceuticals Inc. (CA) 2018-05-24 WO disclosed
EP-2046309-B1 USE OF VITAMIN D3 AGONIST MC903 IN A MAMMALIAN MODEL FOR ATOPIC DISEASES ASS POUR LA RECH A L IGBMC ARI (FR) 2010-12-15 EP disclosed
US-20100144683-A1 METHODS FOR GENERATING MAMMALIAN MODELS OF ATOPIC DISEASES, AND SCREENING FOR THEIR TREATMENT ASSOCIATION POUR LA RECHERCHE A L'IGBMC (ARI) (FR) 2010-06-10 US disclosed
EP-2046309-A2 USE OF VITAMIN D3 AGONIST IN A MAMMALIAN MODEL FOR ATOPIC DISEASES AND OF VITAMIN D3 ANTAGONISTS FOR THE TREATMENT OF ATOPIC DISEASES Association pour la recherche à l'IGBMC (ARI) (FR) 2009-04-15 EP disclosed
WO-2008012645-A2 USE OF VITAMIN D3 AGONIST IN A MAMMALIAN MODEL FOR ATOPIC DISEASES AND OF VITAMIN D3 ANTAGONISTS FOR THE TREATMENT OF ATOPIC DISEASES ASSOCIATION POUR LA RECHERCHE A L'IGBMC (ARI) (FR) 2008-01-31 WO disclosed
US-6331570-B1 PREVENTION OF SPONTANEOUS SQUAMOUS CELL CARCINOMA IN IMMUNOCOMPROMISED HUMAN TRANSPLANT PATIENTS BRISTOL-MYERS SQUIBB COMPANY 2001-12-18 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 (2 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-10980778-B2 Methods for treating multiple osteochondroma (MO) UTRN, VHL, SOST RARB 1620/4885RARG 1720/4885CYP26A1 463/4885
US-20190275005-A1 METHODS FOR TREATING MULTIPLE OSTEOCHONDROMA (MO) UTRN, VHL, SOST RARB 1620/4885RARG 1720/4885CYP26A1 463/4885

“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.