SCHEMBL832284

SCHEMBL832284

Cc1ccc2c(c1)c(-c1ccc(C)[nH]c1=O)c(C(=O)NS(=O)(=O)C(C)C)n2Cc1cc(F)ccc1F

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 10/20 0.34
RXFP1 Q9HBX9 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
CYP2C9 P11712 1/20 0.32
PTGDR Q13258 1/20 0.32
CCNT1 O60563 2/20 0.32
CDK9 P50750 2/20 0.32
ROCK2 O75116 2/20 0.32
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
THRB P10828 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
CYP2C8 P10632 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
SCHEMBL832286 0.94 PTGDR2 (0.37) PTGDR2RXFP1HDAC1HDAC8HDAC6
SCHEMBL831233 0.88 CYP2C8 (0.42) PTGDR2RXFP1CYP2C9PTGDRMEN1
SCHEMBL831314 0.88 SCN9A (0.36) PTGDR2CYP2C9CCNT1CDK9ROCK2
SCHEMBL831919 0.86 TP53 (0.38) PTGDR2RXFP1MEN1ALDH1A1KMT2A
SCHEMBL831842 0.83 KMT2A (0.39) PTGDR2ROCK2MEN1ALDH1A1KMT2A
SCHEMBL831757 0.82 PTGDR2 (0.38) PTGDR2HDAC1HDAC8HDAC6ROCK2
SCHEMBL832279 0.81 PTGDR2 (0.36) PTGDR2RXFP1CYP2C9PTGDRALDH1A1
SCHEMBL833395 0.81 CDK2 (0.33) CYP2C9MEN1ALDH1A1HPGDKMT2A
SCHEMBL832507 0.80 CYP2C8 (0.40) PTGDR2CYP2C9KMT2ACYP2C8
SCHEMBL831703 0.80 CYP2C8 (0.44) PTGDR2RXFP1MEN1ALDH1A1KMT2A

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-8143305-B2 2,3-substituted indole derivatives for treating viral infections SCHERING CORPORATION (US) 2012-03-27 US disclosed
US-8143305-B2 2,3-substituted indole derivatives for treating viral infections SCHERING CORPORATION (US) 2012-03-27 US disclosed
US-20110033417-A1 2,3-SUBSTITUTED INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS MERCK SHARP & DOHME CORP. 2011-02-10 US disclosed
US-20110033417-A1 2,3-SUBSTITUTED INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS MERCK SHARP & DOHME CORP. 2011-02-10 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-20110033417-A1 2,3-SUBSTITUTED INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS IDO2, IDO1, IRF3 PTGDR2 1609/4885RXFP1 2929/4885HDAC1 1123/4885

“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.