SCHEMBL14726929

SCHEMBL14726929

CC(C)(C)c1cc(-c2c3ccccc3c(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3)c3cc(Cl)c(Cl)cc23)cc(C(C)(C)C)c1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RXRB P28702 4/20 0.36
RXRA P19793 3/20 0.36
KIF11 P52732 3/20 0.35
RXRG P48443 2/20 0.35
CNR1 P21554 3/20 0.35
CNR2 P34972 2/20 0.35
AHR P35869 1/20 0.34
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
HSD11B1 P28845 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2A6 P11509 1/20 0.32
ACLY P53396 1/20 0.32
GPR84 Q9NQS5 1/20 0.31
METAP2 P50579 1/20 0.31

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
SCHEMBL14726990 0.86 HSD11B1 (0.40) KIF11CNR1CNR2AHRHSD11B1
SCHEMBL14726974 0.76 ACHE (0.46) AHRKDM4EGAAMAPTCYP1A2
SCHEMBL29274260 0.75 ESR1 (0.50) RXRBRXRARXRGKDM4EGAA
SCHEMBL30956247 0.75 ESR1 (0.50) RXRBRXRARXRGKDM4EGAA
SCHEMBL14726869 0.74 ACHE (0.43) AHRKDM4EMAPTCYP1A2CYP2A6
SCHEMBL6827027 0.72 DPP4 (0.40) KIF11CNR1CNR2AHRGPR84
SCHEMBL9890880 0.71 KDM4E (0.44) RXRBRXRAKIF11RXRGKDM4E
SCHEMBL25632081 0.71 RXRB (0.43) RXRBRXRAKIF11RXRGGPR84
SCHEMBL12682350 0.71 RXRA (0.33) RXRBRXRAKIF11RXRGCNR1
SCHEMBL1322254 0.70 KIF11 (0.49) RXRBRXRAKIF11GPR84

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-8859112-B2 Organic compound and organic light emitting element using the same CANON KABUSHIKI KAISHA (JP) 2014-10-14 US disclosed
US-8859112-B2 Organic compound and organic light emitting element using the same CANON KABUSHIKI KAISHA (JP) 2014-10-14 US disclosed
US-20130049581-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT USING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-02-28 US disclosed
US-20130049581-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT USING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-02-28 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-20130049581-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT USING THE SAME LEF1, CYP1A1, TCF7L2 RXRB 793/4885RXRA 559/4885KIF11 3395/4885

“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.