SCHEMBL1465488

SCHEMBL1465488

O=C(O)c1ccccc1N(C(=O)c1ccc(C(F)(F)F)cc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 2/20 0.45
NR1H3 Q13133 2/20 0.45
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP1A1 P04798 1/20 0.41
MAOB P27338 1/20 0.41
CYP1B1 Q16678 1/20 0.41
TRPA1 O75762 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
HSD11B1 P28845 1/20 0.40
CYP2C8 P10632 1/20 0.40
LTC4S Q16873 1/20 0.39
TAS2R14 Q9NYV8 2/20 0.39
NR1H2 P55055 1/20 0.39

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
SCHEMBL5491908 0.86 AKR1C3 (0.46) RAB9AMEN1KMT2AALDH1A1HPGD
SCHEMBL31393782 0.82 NPC1 (0.51) SRD5A2NR1H3NPC1RAB9ACES2
SCHEMBL28643943 0.80 NPC1 (0.53) SRD5A2NR1H3NPC1RAB9ACES2
SCHEMBL4741896 0.78 PTPN1 (0.40) TRPA1TRPM8LTC4STAS2R14KDM4E
SCHEMBL6440646 0.74 GRIK1 (0.44) SRD5A2RAB9AMEN1KMT2ATAS2R14
SCHEMBL7062441 0.74 PTPN1 (0.54) MEN1KMT2AALDH1A1
SCHEMBL38533242 0.73 AKR1C3 (0.66) SRD5A2NPC1RAB9ACRHBPCRHR2
SCHEMBL11751786 0.73 AKR1C3 (0.66) SRD5A2NPC1RAB9ACRHBPCRHR2
SCHEMBL2097683 0.73 NPSR1 (0.48) SRD5A2NPC1RAB9ACES2CES1
SCHEMBL2112754 0.72 ESR1 (0.55) SRD5A2CES2CES1CYP1A1CYP1B1

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-20110071197-A1 BIS-ARYL COMPOUNDS FOR USE AS MEDICAMENTS BIOLIPOX AB (LV) 2011-03-24 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-20110071197-A1 BIS-ARYL COMPOUNDS FOR USE AS MEDICAMENTS LTC4S, LTB4R2, LTB4R SRD5A2 918/4885NR1H3 662/4885NPC1 1827/4885

“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.