SCHEMBL836742

SCHEMBL836742

COc1ccc(/C=C/C(=O)N(O)c2ccccc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 5/20 0.76
LMNA P02545 1/20 0.64
BCHE P06276 1/20 0.60
CYP3A4 P08684 1/20 0.60
NFKB1 P19838 1/20 0.60
NFKB2 Q00653 1/20 0.60
RELA Q04206 1/20 0.60
THRB P10828 1/20 0.59
ATM Q13315 1/20 0.59
KDM4E B2RXH2 1/20 0.57
HPGD P15428 1/20 0.57
F3 P13726 1/20 0.57
MAPT P10636 3/20 0.56
MAOB P27338 2/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
ALDH1A1 P00352 1/20 0.56
HSPD1 P10809 1/20 0.56
TNFRSF1A P19438 1/20 0.56
HSPE1 P61604 1/20 0.56

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
SCHEMBL836743 1.00 TRPM8 (0.76) TRPM8LMNABCHECYP3A4NFKB1
SCHEMBL10270950 0.87 TRPM8 (1.00) TRPM8LMNABCHECYP3A4NFKB1
SCHEMBL30532218 0.87 TRPM8 (1.00) TRPM8LMNABCHECYP3A4NFKB1
SCHEMBL18536887 0.85 TRPM8 (0.76) TRPM8LMNABCHECYP3A4NFKB1
SCHEMBL836333 0.84 TRPM8 (0.70) TRPM8LMNABCHEF3MAPT
SCHEMBL836332 0.84 TRPM8 (0.70) TRPM8LMNABCHEF3MAPT
SCHEMBL10270951 0.82 TRPM8 (1.00) TRPM8LMNABCHECYP3A4NFKB1
SCHEMBL18536909 0.82 TRPM8 (0.83) TRPM8LMNABCHECYP3A4NFKB1
SCHEMBL10270945 0.81 TRPM8 (1.00) TRPM8LMNABCHECYP3A4NFKB1
SCHEMBL18537071 0.80 TRPM8 (0.88) TRPM8LMNABCHECYP3A4NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143423-B2 N-heterocyclic carbene (NHC) catalyzed synthesis of hydroxamic acids AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2012-03-27 US disclosed
US-8143423-B2 N-heterocyclic carbene (NHC) catalyzed synthesis of hydroxamic acids AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2012-03-27 US disclosed
US-8143423-B2 N-heterocyclic carbene (NHC) catalyzed synthesis of hydroxamic acids AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2012-03-27 US disclosed
US-20100105921-A1 N-HETEROCYCLIC CARBENE (NHC) CATALYZED SYNTHESIS OF HYDROXAMIC ACIDS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2010-04-29 US disclosed
US-20100105921-A1 N-HETEROCYCLIC CARBENE (NHC) CATALYZED SYNTHESIS OF HYDROXAMIC ACIDS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2010-04-29 US disclosed
US-20100105921-A1 N-HETEROCYCLIC CARBENE (NHC) CATALYZED SYNTHESIS OF HYDROXAMIC ACIDS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2010-04-29 US disclosed
WO-2008115153-A1 N-HETEROCYCLIC CARBENE (NHC) CATALYZED SYNTHESIS OF HYDROXAMIC ACIDS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2008-09-25 WO 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-20100105921-A1 N-HETEROCYCLIC CARBENE (NHC) CATALYZED SYNTHESIS OF HYDROXAMIC ACIDS NDC1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HAO2 TRPM8 4490/4885LMNA 802/4885BCHE 2228/4885

“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.