SCHEMBL768815

SCHEMBL768815

CCOC(=O)c1noc(-c2ccc(C)cc2)c1CNC(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 8/20 0.52
TARBP2 Q15633 1/20 0.45
KCNH2 Q12809 1/20 0.45
RAB9A P51151 1/20 0.42
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
TDP2 O95551 2/20 0.39
MLYCD O95822 1/20 0.39
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
ADRB3 P13945 1/20 0.38
ALDH1A1 P00352 1/20 0.38
PKM P14618 1/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL766796 0.88 TRPV1 (0.68) TRPV1KCNH2MLYCDMAPT
SCHEMBL768664 0.85 TRPV1 (0.55) TRPV1KCNH2RAB9AALDH1A1MEN1
SCHEMBL768606 0.82 TARBP2 (0.50) TARBP2RAB9ACYP1A2CYP2C9CYP2C19
SCHEMBL31587044 0.74 ADORA3 (0.50) TARBP2RAB9ACYP1A2CYP2C9CYP2C19
SCHEMBL766776 0.72 TRPV1 (0.75) TRPV1KCNH2
SCHEMBL766813 0.71 TRPV1 (0.62) TRPV1MLYCDMEN1MAPTKMT2A
SCHEMBL766505 0.70 MLYCD (0.52) TRPV1MLYCDMEN1MAPTKMT2A
SCHEMBL13256885 0.70 MLYCD (0.52) TRPV1MLYCDMEN1MAPTKMT2A
SCHEMBL766592 0.70 TRPV1 (0.73) TRPV1KCNH2
SCHEMBL766721 0.70 TRPV1 (0.80) TRPV1KCNH2

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-20120071481-A1 ISOXAZOLE-5-CARBOXAMIDE DERIVATIVES MERCK SHARP & DOHME B.V. (NL) 2012-03-22 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-20120071481-A1 ISOXAZOLE-5-CARBOXAMIDE DERIVATIVES TRPV1, TRPV5, TRPV3 TRPV1 1/4885TARBP2 3588/4885KCNH2 239/4885

“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.