SCHEMBL21474633

SCHEMBL21474633

Cc1ccc(-c2nc3c(C)ccc(C)c3s2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARA P10276 1/20 0.48
RARB P10826 1/20 0.48
RARG P13631 1/20 0.48
GAA P10253 3/20 0.47
KDM4E B2RXH2 3/20 0.47
RAB9A P51151 3/20 0.47
ALOX5 P09917 4/20 0.45
COMT P21964 1/20 0.43
SMN1; SMN2 Q16637 4/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 1/20 0.42
APP P05067 4/20 0.40
MAPT P10636 4/20 0.40
SNCA P37840 1/20 0.40
AHR P35869 1/20 0.40
TP53 P04637 2/20 0.38
GLA P06280 2/20 0.38
CYP3A4 P08684 1/20 0.38
HPGD P15428 1/20 0.38
NT5E P21589 1/20 0.38

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
SCHEMBL20349615 0.87 RARA (0.44) RARARARBRARGGAAKDM4E
SCHEMBL21533341 0.86 APP (0.46) RARARARBRARGGAAALOX5
SCHEMBL22174649 0.86 RARA (0.49) RARARARBRARGGAAKDM4E
SCHEMBL8534672 0.86 GAA (0.52) RARARARBRARGGAAKDM4E
SCHEMBL18873092 0.85 ADORA3 (0.49) RARARARBRARGGAAKDM4E
SCHEMBL21474669 0.84 PIK3CD (0.44) RARARARBRARGGAAKDM4E
SCHEMBL17059008 0.83 APP (0.49) RARARARBRARGGAAKDM4E
SCHEMBL17059006 0.82 APP (0.44) RARARARBRARGGAAKDM4E
SCHEMBL20349639 0.82 NPC1 (0.49) RARARARBRARGGAAKDM4E
SCHEMBL21474677 0.81 KDM4E (0.46) GAAKDM4ERAB9AALOX5COMT

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-20200115482-A1 MIXTURE, POLYMER, OPTICAL FILM, OPTICALLY ANISOTROPIC PRODUCT, POLARIZING PLATE, DISPLAY DEVICE, ANTIREFLECTION FILM, AND PRODUCTION METHOD FOR MIXTURE ZEON CORPORATION (JP) 2020-04-16 US disclosed
US-20200031971-A1 MIXTURE, POLYMERIZABLE COMPOSITION, POLYMER, OPTICAL FILM, OPTICALLY ANISOTROPIC PRODUCT, POLARIZING PLATE, FLAT PANEL DISPLAY DEVICE, ORGANIC ELECTROLUMINESCENT DISPLAY DEVICE, ANTIREFLECTION FILM, AND METHOD OF USING POLYMERIZABLE COMPOUND ZEON CORPORATION (JP) 2020-01-30 US disclosed
US-20190330399-A1 POLYMERIZABLE COMPOUND, MIXTURE, POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, POLYMER, OPTICAL FILM, OPTICALLY ANISOTROPIC BODY, POLARIZER, DISPLAY, AND ANTIREFLECTION FILM ZEON CORPORATION (JP) 2019-10-31 US disclosed
US-20190315893-A1 POLYMERIZABLE COMPOUND, MIXTURE, POLYMER, OPTICAL FILM, OPTICALLY ANISOTROPIC PRODUCT, POLARIZING PLATE, DISPLAY DEVICE, AND ANTIREFLECTION FILM ZEON CORPORATION (JP) 2019-10-17 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-20190315893-A1 POLYMERIZABLE COMPOUND, MIXTURE, POLYMER, OPTICAL FILM, OPTICALLY ANISOTROPIC PRODUCT, POLARIZING PLATE, DISPLAY DEVICE, AND ANTIREFLECTION FILM CCNA1, CCNA2, ADRA1A RARA 312/4885RARB 978/4885RARG 951/4885

“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.