SCHEMBL1753395

SCHEMBL1753395

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nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAS2R46 P59540 12/20 0.62
TAS2R31 P59538 2/20 0.46
TAS2R10 Q9NYW0 2/20 0.46
RECQL P46063 2/20 0.41
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TERT O14746 1/20 0.38
PKM P14618 1/20 0.38
PTPN1 P18031 2/20 0.35
PTPN2 P17706 1/20 0.34

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
SCHEMBL30834897 1.00 TAS2R46 (0.62) TAS2R46TAS2R31TAS2R10RECQLALOX15
SCHEMBL10307305 1.00 TAS2R46 (0.62) TAS2R46TAS2R31TAS2R10RECQLALOX15
SCHEMBL18409983 0.84 TAS2R46 (0.49) TAS2R46TAS2R31TAS2R10RECQLALOX15
SCHEMBL10307313 0.80 TAS2R46 (0.61) TAS2R46TAS2R31TAS2R10RECQLMEN1
SCHEMBL1753501 0.80 TAS2R46 (0.61) TAS2R46TAS2R31TAS2R10RECQLMEN1
SCHEMBL27183431 0.78 TAS2R46 (0.59) TAS2R46TAS2R31TAS2R10RECQLMEN1
SCHEMBL27183429 0.78 TAS2R46 (0.59) TAS2R46TAS2R31TAS2R10RECQLMEN1
SCHEMBL27183427 0.78 TAS2R46 (0.59) TAS2R46TAS2R31TAS2R10RECQLMEN1
SCHEMBL30462356 0.77 TAS2R46 (1.00) TAS2R46TAS2R31TAS2R10RECQLMEN1
Dihydro Costunolide SCHEMBL31238153 0.74 TAS2R46 (1.00) TAS2R46TAS2R31TAS2R10RECQLMEN1

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-8158372-B2 Agonists of a bitter taste receptor and uses thereof DEUTSCHES INSTITUT FÜR ERNÄHRUNGSFORSCHUNG POTSDAM-REHBRÜCKE (DE) 2012-04-17 US disclosed
US-8158372-B2 Agonists of a bitter taste receptor and uses thereof DEUTSCHES INSTITUT FÜR ERNÄHRUNGSFORSCHUNG POTSDAM-REHBRÜCKE (DE) 2012-04-17 US disclosed
US-20100056621-A1 AGONISTS OF A BITTER TASTE RECEPTOR AND USES THEREOF DEUTSCHES INSTITUT FUR ERNAHRUNGSFORSCHUNG (DE) 2010-03-04 US disclosed
US-20100056621-A1 AGONISTS OF A BITTER TASTE RECEPTOR AND USES THEREOF DEUTSCHES INSTITUT FUR ERNAHRUNGSFORSCHUNG (DE) 2010-03-04 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-20100056621-A1 AGONISTS OF A BITTER TASTE RECEPTOR AND USES THEREOF TAS2R4, TAS2R30, TAS2R40 TAS2R46 25/4885TAS2R31 15/4885TAS2R10 6/4885

“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.