SCHEMBL8115181

SCHEMBL8115181

CC(C)(C)C(=O)Nc1cnc2ccccc2c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.65
KDM4E B2RXH2 4/20 0.65
CNR2 P34972 6/20 0.64
CNR1 P21554 4/20 0.64
KDR P35968 1/20 0.62
RAB9A P51151 8/20 0.62
NPC1 O15118 7/20 0.62
SMN1; SMN2 Q16637 5/20 0.62
POLB P06746 2/20 0.62
MAPT P10636 2/20 0.62
HSD17B10 Q99714 2/20 0.60
LMNA P02545 1/20 0.60
TSHR P16473 1/20 0.60
MITF O75030 1/20 0.60
XBP1 P17861 1/20 0.60
PAX8 Q06710 1/20 0.60
KLF5 Q13887 1/20 0.60
ALDH1A1 P00352 1/20 0.58
NPSR1 Q6W5P4 1/20 0.57
NOTUM Q6P988 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
SCHEMBL879571 0.83 KDM4E (0.70) TRPV1KDM4EKDRRAB9ANPC1
SCHEMBL15219027 0.83 TRPV1 (0.59) TRPV1KDM4ECNR2CNR1KDR
SCHEMBL27999192 0.83 RAB9A (0.58) TRPV1KDM4ECNR2CNR1KDR
SCHEMBL1621548 0.83 CNR2 (0.71) TRPV1KDM4ECNR2CNR1KDR
SCHEMBL29433018 0.82 RAB9A (0.67) TRPV1KDM4ECNR2CNR1KDR
SCHEMBL27866684 0.82 NPC1 (0.80) TRPV1KDM4EKDRRAB9ANPC1
SCHEMBL240482 0.81 TRPV1 (0.61) TRPV1KDM4ECNR2CNR1KDR
SCHEMBL651159 0.81 KDR (0.74) TRPV1KDM4EKDRRAB9ANPC1
SCHEMBL8115168 0.81 NPC1 (0.70) RAB9ANPC1SMN1; SMN2POLBMAPT
SCHEMBL22355984 0.81 RAB9A (0.56) TRPV1KDM4ECNR2CNR1KDR

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-20070293530-A1 SULFAMIDE AND SULFAMATE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS METHYLGENE INC. (CA) 2007-12-20 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-20070293530-A1 SULFAMIDE AND SULFAMATE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC11, HAT1 TRPV1 2943/4885KDM4E 215/4885CNR2 1509/4885

“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.