SCHEMBL6450433

SCHEMBL6450433

Cc1cc2c(cc1-c1cc(C=C3SC(=O)NC3=O)ccc1OC(F)(F)F)C(C)(C)C=CC2(C)C

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RXRA P19793 3/20 0.66
SCN9A Q15858 1/20 0.55
PIM1 P11309 7/20 0.51
PIM2 Q9P1W9 7/20 0.51
PDE4B Q07343 2/20 0.47
PIM3 Q86V86 1/20 0.47
TTR P02766 1/20 0.46
CISD1 Q9NZ45 1/20 0.46
HPGD P15428 4/20 0.45
ESRRA P11474 3/20 0.44
CYP3A4 P08684 1/20 0.44
PTPN1 P18031 1/20 0.43

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
SCHEMBL6450432 1.00 RXRA (0.66) RXRASCN9APIM1PIM2PDE4B
SCHEMBL1619112 0.90 RXRA (0.69) RXRASCN9APIM1PIM2PDE4B
SCHEMBL304434 0.90 RXRA (0.69) RXRASCN9APIM1PIM2PDE4B
SCHEMBL304433 0.90 RXRA (0.69) RXRASCN9APIM1PIM2PDE4B
SCHEMBL28294020 0.87 SCN9A (0.56) RXRASCN9APIM1PIM2PDE4B
SCHEMBL5757584 0.86 RXRA (0.63) RXRASCN9APIM1PIM2PDE4B
SCHEMBL5791119 0.86 RXRA (0.63) RXRASCN9APIM1PIM2PDE4B
SCHEMBL6028226 0.85 RXRA (0.63) RXRASCN9APIM1PIM2PDE4B
SCHEMBL6028228 0.85 RXRA (0.63) RXRASCN9APIM1PIM2PDE4B
SCHEMBL5758355 0.84 RXRA (0.69) RXRASCN9APIM1PIM2PDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050038098-A1 Substituted dihydronaphthalene and isochroman compounds for the treatment of metabolic disorders, cancer and other diseases INCYTE CORPORATION 2005-02-17 US claimed
US-20050038098-A1 Substituted dihydronaphthalene and isochroman compounds for the treatment of metabolic disorders, cancer and other diseases INCYTE CORPORATION 2005-02-17 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-20050038098-A1 Substituted dihydronaphthalene and isochroman compounds for the treatment of metabolic disorders, cancer and other diseases HSD17B10, IDH2, INSR RXRA 1054/4885SCN9A 4598/4885PIM1 708/4885

“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.