SCHEMBL6504019

SCHEMBL6504019

NCc1ccc2[nH]c(C(CCCCO)n3c(=O)n(CC(F)(F)F)c(=O)c4ccccc43)nc2c1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RORA P35398 1/20 0.31
RORC P51449 1/20 0.31
RORB Q92753 1/20 0.31
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL6242833 0.94 RORA (0.32) RORARORCRORB
SCHEMBL6499434 0.88 PDE4B (0.31)
SCHEMBL6274099 0.83 NPSR1 (0.34) ALDH1A1
SCHEMBL6246745 0.78 ALDH1A1 (0.33) ALDH1A1
SCHEMBL6247453 0.77 NPSR1 (0.38) ALDH1A1
SCHEMBL6504017 0.72 CYP3A4 (0.42) RORARORCRORB
SCHEMBL6257575 0.72 SMN1; SMN2 (0.32) ALDH1A1
SCHEMBL6264030 0.72 SLC6A2 (0.35) ALDH1A1
SCHEMBL3824238 0.71 SLC6A2 (0.43) ALDH1A1HPGD
SCHEMBL6245910 0.70 CYP3A4 (0.41)

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-6919331-B2 Substituted 2-methyl-benzimidazole respiratory syncytial virus antiviral agents BRISTOL-MYERS SQUIBB COMPANY (US) 2005-07-19 US disclosed
US-20030207868-A1 Substituted 2-methyl-benzimidazole respiratory syncytial virus antiviral agents BRISTOL-MYERS SQUIBB COMPANY 2003-11-06 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-20030207868-A1 Substituted 2-methyl-benzimidazole respiratory syncytial virus antiviral agents MAVS, ZC3HAV1, EIF2AK2 RORA 1844/4885RORC 1110/4885RORB 1622/4885

“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.