SCHEMBL13698343

SCHEMBL13698343

CCc1[nH]c2ccc(OC)cc2c1SC(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 7/20 0.52
HTR1D P28221 2/20 0.52
HTR1A P08908 1/20 0.52
HTR2A P28223 1/20 0.52
HTR2C P28335 1/20 0.52
HTR1E P28566 1/20 0.52
HTR7 P34969 1/20 0.52
HTR5A P47898 1/20 0.52
ALDH1A1 P00352 5/20 0.50
KDM4E B2RXH2 4/20 0.50
MAPT P10636 4/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
HSD17B10 Q99714 2/20 0.50
TSHR P16473 1/20 0.50
GFER P55789 1/20 0.50
MCL1 Q07820 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
HPGD P15428 3/20 0.44
TUBB4A P04350 5/20 0.42

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
SCHEMBL12510343 0.84 ALDH1A1 (0.45) HTR6HTR1DHTR1AHTR2AHTR2C
SCHEMBL12209489 0.83 AKR1C2 (0.55) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL1193617 0.82 ALDH1A1 (0.50) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL9217686 0.80 TUBB4A (0.44) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL12510345 0.80 GAA (0.39) HTR6HTR1DHTR2AHTR2CHTR7
SCHEMBL9150374 0.76 ALDH1A1 (0.68) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL22722590 0.76 HTR6 (0.59) HTR6HTR1DHTR1AHTR2AHTR2C
SCHEMBL12510346 0.74 KDM4E (0.33) HTR6HTR1DHTR1AHTR2AHTR2C
SCHEMBL15902404 0.71 AHR (0.58) HTR6HTR1DHTR1AHTR2AHTR2C
SCHEMBL9200463 0.71 HTR6 (0.75) HTR6HTR1DHTR1AHTR2AHTR2C

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-20090221574-A1 5-Lipoxygenase-Activating Protein (FLAP) Inhibitors AMIRA PHARMACEUTICALS, INC. (US) 2009-09-03 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-20090221574-A1 5-Lipoxygenase-Activating Protein (FLAP) Inhibitors ALOX5, ALOX15B, ALOX15 HTR6 2058/4885HTR1D 1720/4885HTR1A 842/4885

“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.