SCHEMBL5010345

SCHEMBL5010345

COC(=O)c1ccc(C(=O)NC(C)(C(C)C)C(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.53
MAPT P10636 4/20 0.53
CA1 P00915 3/20 0.48
CA2 P00918 3/20 0.48
CA12 O43570 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
TSHR P16473 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
ATM Q13315 1/20 0.45
ALDH1A1 P00352 2/20 0.44
NOTUM Q6P988 1/20 0.44
POLB P06746 1/20 0.44
LOXL2 Q9Y4K0 1/20 0.43
PTPN1 P18031 1/20 0.43
HPGD P15428 1/20 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
SCHEMBL15526785 0.85 MAPT (0.57) TDP1MAPTCA1CA2MEN1
SCHEMBL6419787 0.82 MAPT (0.60) TDP1MAPTCA1CA2CA12
SCHEMBL13994623 0.80 POLB (0.56) TDP1MAPTCA1CA12CA9
SCHEMBL5011867 0.78 NPC1 (0.53) TDP1MAPTMEN1KMT2ANPC1
SCHEMBL2246931 0.77 CA1 (0.50) TDP1MAPTCA1CA2CA12
SCHEMBL600655 0.76 MAPT (0.58) TDP1MAPTCA1CA2CA12
SCHEMBL14369281 0.76 MAPT (0.58) TDP1MAPTCA1CA2CA12
SCHEMBL13753393 0.76 MAPT (0.62) TDP1MAPTCA1CA2CA12
SCHEMBL5561230 0.74 MAPT (0.60) TDP1MAPTCA1CA2CA12
SCHEMBL23600 0.74 CA1 (0.80) TDP1MAPTCA1CA2CA12

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080319055-A1 Cooling Compounds GIVAUDAN SA (CH) 2008-12-25 US disclosed
US-20080319055-A1 Cooling Compounds GIVAUDAN SA (CH) 2008-12-25 US disclosed
US-20080319055-A1 Cooling Compounds GIVAUDAN SA (CH) 2008-12-25 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-20080319055-A1 Cooling Compounds TAS2R1, TAS2R43, TAS2R3 TDP1 2571/4885MAPT 2788/4885CA1 717/4885

“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.