SCHEMBL14937640

SCHEMBL14937640

Cc1ccc(COC(=O)C2CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.52
MAPT P10636 2/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
GAA P10253 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ALDH1A1 P00352 3/20 0.49
NAAA Q02083 1/20 0.48
POLB P06746 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MMP1 P03956 1/20 0.44
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
MMP12 P39900 1/20 0.44
GRIN2B Q13224 1/20 0.44
KDM4E B2RXH2 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
SCHEMBL31518983 0.92 POLB (0.53) HPGDMAPTNPC1RAB9AGAA
SCHEMBL11834516 0.91 GAA (0.46) NPC1RAB9AGAASMN1; SMN2ALDH1A1
SCHEMBL28114437 0.86 FABP7 (0.43) SMN1; SMN2ALDH1A1MEN1KMT2AKDM4E
SCHEMBL11851534 0.83 ALDH1A1 (0.47) HPGDMAPTNPC1RAB9AGAA
SCHEMBL8502974 0.83 FABP7 (0.58) NPC1RAB9ASMN1; SMN2ALDH1A1POLB
SCHEMBL8191635 0.83 FABP7 (0.58) NPC1RAB9ASMN1; SMN2ALDH1A1POLB
SCHEMBL28841067 0.82 FABP7 (0.56) HPGDMAPTGAASMN1; SMN2ALDH1A1
SCHEMBL28520882 0.82 FABP7 (0.56) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL14937275 0.82 MEN1 (0.56) MAPTALDH1A1POLBMEN1KMT2A
SCHEMBL28288204 0.82 MEN1 (0.43) GAAALDH1A1MEN1KMT2AKDM4E

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-8822724-B2 Method for producing carboxylic acid amide SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-09-02 US disclosed
EP-2599769-A1 METHOD FOR PRODUCING CARBOXYLIC ACID AMIDE Sumitomo Chemical Company Limited (JP) 2013-06-05 EP disclosed
US-20130123505-A1 METHOD FOR PRODUCING CARBOXYLIC ACID AMIDE SUMITOMO CHEMICAL COMPANY, LIMITED 2013-05-16 US disclosed
CN-103025706-A Method for producing carboxylic acid amide SUMITOMO CHEMICAL CO 2013-04-03 CN 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-20130123505-A1 METHOD FOR PRODUCING CARBOXYLIC ACID AMIDE HCAR2, NAAA, FAAH2 HPGD 743/4885MAPT 3830/4885NPC1 3154/4885

“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.