SCHEMBL2736551

SCHEMBL2736551

Cc1cc(C)n(C)c(=O)c1C(=O)NCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.60
KMT2A Q03164 7/20 0.60
NPC1 O15118 2/20 0.60
RAB9A P51151 1/20 0.60
CYP2C19 P33261 1/20 0.59
ALDH1A1 P00352 5/20 0.56
KDM4E B2RXH2 2/20 0.56
GAA P10253 1/20 0.56
MAPT P10636 1/20 0.56
EGFR P00533 1/20 0.54
SRC P12931 1/20 0.54
MMP1 P03956 1/20 0.53
MMP7 P09237 1/20 0.53
MMP9 P14780 1/20 0.53
MMP8 P22894 1/20 0.53
MMP13 P45452 1/20 0.53
HPGD P15428 1/20 0.52
HSD17B10 Q99714 1/20 0.52
CNR1 P21554 2/20 0.51
CNR2 P34972 2/20 0.51

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
SCHEMBL2736550 0.87 L3MBTL1 (0.60) MEN1KMT2ANPC1RAB9AKDM4E
SCHEMBL13991203 0.83 CNR2 (0.65) MEN1KMT2ACYP2C19ALDH1A1KDM4E
SCHEMBL2736552 0.80 MEN1 (0.61) MEN1KMT2ANPC1RAB9ACYP2C19
SCHEMBL2736556 0.76 CNR1 (0.70) MEN1KMT2ANPC1RAB9ACYP2C19
SCHEMBL7201120 0.75 MEN1 (1.00) MEN1KMT2ANPC1RAB9AKDM4E
SCHEMBL6381995 0.71 TSHR (0.54) MEN1KMT2ANPC1CYP2C19ALDH1A1
SCHEMBL5757403 0.71 CNR1 (0.64) MEN1KMT2ACYP2C19ALDH1A1KDM4E
SCHEMBL13617372 0.71 MEN1 (0.64) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL13591317 0.70 BRD4 (0.67) MEN1KMT2ARAB9ACYP2C19ALDH1A1
SCHEMBL2859054 0.69 POLB (0.71) MEN1KMT2ANPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088924-B2 Pyridone derivatives having a binding activity to the cannabinoid type 2 receptor SHIONOGI & CO., LTD. (JP) 2012-01-03 US disclosed
US-20100081686-A1 Pyridone derivatives having a binding activity to the cannabinoid type 2 recepter TADA YUKIO 2010-04-01 US disclosed
US-7652141-B2 Immunosuppressants, analgesics, antiinflammatory agents SHIONOGI & CO., LTD. (JP) 2010-01-26 US disclosed
US-20080312292-A1 Antipruritics YASUI KIYOSHI 2008-12-18 US disclosed
US-20070027144-A1 Novel use of cannabinoid receptor agonist SHIONOGI & CO., LTD. (JP) 2007-02-01 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 (3 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-20070027144-A1 Novel use of cannabinoid receptor agonist CNR2, CNR1, OPRM1 MEN1 4737/4885KMT2A 2110/4885NPC1 3215/4885
US-20100081686-A1 Pyridone derivatives having a binding activity to the cannabinoid type 2 recepter CNR2, CNR1, NPY2R MEN1 3159/4885KMT2A 2963/4885NPC1 4500/4885
US-20080312292-A1 Antipruritics CNR1, CNR2, OPRL1 MEN1 4507/4885KMT2A 2819/4885NPC1 2141/4885

“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.