SCHEMBL18059273

SCHEMBL18059273

C=C(/C=C(C)\C(C)=C/NC)c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARG P13631 14/20 0.49
▸ RXRA P19793 12/20 0.49
▸ RARB P10826 12/20 0.49
▸ RARA P10276 12/20 0.49
▸ RXRB P28702 7/20 0.49
▸ RXRG P48443 6/20 0.49
▸ CYP26A1 O43174 4/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ CYP1A2 P05177 2/20 0.45
▸ CYP3A4 P08684 2/20 0.45
▸ CYP2C19 P33261 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ GMNN O75496 1/20 0.45
▸ USP2 O75604 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ NFKB1 P19838 1/20 0.45

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
SCHEMBL3301372 0.73 RARB (0.61) RARGRXRARARBRARARXRB
SCHEMBL17518750 0.72 HPGD (0.38) ALDH1A1KDM4ENPC1LMNARAB9A
SCHEMBL16627767 0.70 MEN1 (0.38) ALDH1A1KDM4ENPC1LMNAPOLB
SCHEMBL12515953 0.70 RARB (0.66) RARGRXRARARBRARARXRB
SCHEMBL2195224 0.70 RXRA (0.66) RARGRXRARARBRARARXRB
SCHEMBL8845981 0.69 RARG (0.58) RARGRXRARARBRARARXRB
SCHEMBL8845976 0.69 RARG (0.58) RARGRXRARARBRARARXRB
SCHEMBL13407891 0.69 RARB (0.64) RARGRXRARARBRARARXRB
SCHEMBL8183716 0.69 RXRA (0.66) RARGRXRARARBRARARXRB
SCHEMBL7876468 0.69 RXRA (0.66) RARGRXRARARBRARARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160260913-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2016-09-08 — — 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-20160260913-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES EML4, TYR, L1CAM RARG 55/4885RXRA 361/4885RARB 51/4885

“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.

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