SCHEMBL13403221

SCHEMBL13403221

Cc1c(C(=O)/C=C/C2CCCCC2)c(=O)oc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
PADI4 Q9UM07 4/20 0.48
HTT P42858 4/20 0.47
LMNA P02545 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
TP53 P04637 2/20 0.47
CRHBP P24387 1/20 0.47
CRHR2 Q13324 1/20 0.47
HPGD P15428 2/20 0.46
CYP2C19 P33261 1/20 0.46
KDM4E B2RXH2 3/20 0.44
NQO1 P15559 3/20 0.44
RECQL P46063 2/20 0.44
MAPT P10636 1/20 0.44
GPR55 Q9Y2T6 1/20 0.44
TSHR P16473 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MAPK1 P28482 1/20 0.44

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
SCHEMBL14514822 0.87 LMNA (0.60) RAB9APADI4HTTLMNAMEN1
SCHEMBL13403201 0.78 PADI4 (0.39) RAB9ANPC1PADI4HTTMEN1
SCHEMBL12374651 0.78 PADI4 (0.65) RAB9ANPC1PADI4KMT2ATP53
SCHEMBL13403222 0.76 NQO1 (0.63) RAB9ANPC1HTTLMNAMEN1
SCHEMBL13403211 0.76 PADI4 (0.37) PADI4
SCHEMBL14514826 0.74 PADI4 (0.50) RAB9ANPC1PADI4MEN1KMT2A
SCHEMBL13403218 0.74 MEN1 (0.40) RAB9ANPC1PADI4HTTMEN1
SCHEMBL15233104 0.74 PADI4 (0.37) RAB9ANPC1PADI4HTTLMNA
SCHEMBL2808497 0.72 KDM4E (0.57) HTTLMNAMEN1KMT2AHPGD
SCHEMBL30776764 0.72 KDM4E (0.57) HTTLMNAMEN1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8524729-B2 Cinnamoyl derivatives and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-09-03 US disclosed
US-7691883-B2 Cinnamoyl compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-06 US disclosed
US-20070265228-A1 Cinnamoyl compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-11-15 US disclosed
US-20070123521-A1 Cinnamoyl derivatives and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-31 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 (2 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-20070265228-A1 Cinnamoyl compound and use of the same NPC1, CES2, CYP51A1 RAB9A 2540/4885NPC1 1/4885PADI4 3465/4885
US-20070123521-A1 Cinnamoyl derivatives and use thereof CES2, EBP, CPT1A RAB9A 3002/4885NPC1 4/4885PADI4 2457/4885

“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.