SCHEMBL8459704

SCHEMBL8459704

Cc1ccc(NC(=O)c2ccc3c(c2)C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARA P10276 8/20 0.80
CYP26A1 O43174 8/20 0.80
RARB P10826 7/20 0.80
RARG P13631 7/20 0.80
CYP3A4 P08684 3/20 0.80
MEN1 O00255 2/20 0.80
KMT2A Q03164 2/20 0.80
ALDH1A1 P00352 2/20 0.80
CYP1A2 P05177 1/20 0.80
CYP2C9 P11712 1/20 0.80
TSHR P16473 1/20 0.80
MAPK1 P28482 1/20 0.80
CYP2C19 P33261 1/20 0.80
CYP26B1 Q9NR63 5/20 0.70
PGR P06401 1/20 0.67
ADORA3 P0DMS8 1/20 0.67
TBXA2R P21731 1/20 0.67
BLVRB P30043 1/20 0.67
NPC1 O15118 5/20 0.58
RAB9A P51151 5/20 0.58

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
SCHEMBL19560600 0.91 RARA (0.80) RARACYP26A1RARBRARGCYP3A4
SCHEMBL9446527 0.89 CYP26A1 (0.80) RARACYP26A1RARBRARGCYP3A4
SCHEMBL726740 0.89 RARB (1.00) RARACYP26A1RARBRARGCYP3A4
SCHEMBL29355626 0.89 RARB (1.00) RARACYP26A1RARBRARGCYP3A4
SCHEMBL1616078 0.87 CYP26A1 (0.78) RARACYP26A1RARBRARGCYP3A4
SCHEMBL1616121 0.87 CYP26A1 (0.78) RARACYP26A1RARBRARGCYP3A4
SCHEMBL9446600 0.87 RARA (0.78) RARACYP26A1RARBRARGCYP3A4
SCHEMBL7621355 0.87 RARA (0.82) RARACYP26A1RARBRARGCYP3A4
SCHEMBL8461267 0.86 RARA (0.76) RARACYP26A1RARBRARGCYP3A4
SCHEMBL1615390 0.86 RARA (0.76) RARACYP26A1RARBRARGCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10221392-B2 Generation of pancreatic endoderm from pluripotent stem cells using small molecules NOVO NORDISK A/S (DK) 2019-03-05 US disclosed
US-20150246075-A1 METHODS FOR ENHANCING HEMATOPOIETIC STEM/PROGENITOR CELL ENGRAFTMENT CHILDREN'S MEDICAL CENTER CORPORATION 2015-09-03 US disclosed
US-9056085-B2 Methods for enhancing hematopoietic stem/progenitor cell engraftment CHILDREN'S MEDICAL CENTER CORPORATION (US) 2015-06-16 US disclosed
US-5869067-A TREATING DERMATOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1999-02-09 US disclosed
US-5753239-A Bi-aromatic compounds and pharmaceutical and cosmetic compositions CENTRE INTERNATIONAL DE RECHERCHES DEMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1998-05-19 US disclosed
EP-0514269-B1 Imino-derivatives, process for their preparation and their use in human and veterinary medicine and in cosmetics CIRD GALDERMA (FR) 1995-11-02 EP disclosed
EP-0514269-A1 Imino-derivatives, process for their preparation and their use in human and veterinary medicine and in cosmetics CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA, ( CIRD GALDERMA) (FR) 1992-11-19 EP 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-20150246075-A1 METHODS FOR ENHANCING HEMATOPOIETIC STEM/PROGENITOR CELL ENGRAFTMENT HCLS1, MCL1, THPO RARA 183/4885CYP26A1 2754/4885RARB 46/4885

“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.