SCHEMBL2459930

SCHEMBL2459930

C=CCC1CCOCCN1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.33
RAB9A P51151 1/20 0.33
TSHR P16473 1/20 0.32
MAPT P10636 1/20 0.32
GLA P06280 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
ELANE P08246 1/20 0.31
CTSG P08311 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL1502273 0.85 PDK1 (0.38) HSD17B10RAB9A
SCHEMBL11969732 0.85 HSD17B10 (0.34) HSD17B10TSHRGLASMN1; SMN2KDM4E
SCHEMBL5992716 0.83 ELANE (0.35) ELANECTSGMEN1KMT2A
SCHEMBL27855134 0.80 POLB (0.44) HSD17B10MEN1KMT2A
SCHEMBL29060151 0.80 POLB (0.44) HSD17B10MEN1KMT2A
SCHEMBL11995193 0.79 USP2 (0.47) HSD17B10TSHRSMN1; SMN2ELANECTSG
SCHEMBL7073933 0.78 CHRNB2 (0.40) RAB9AMAPTMEN1KMT2A
SCHEMBL20855368 0.71 ELANE (0.33) ELANECTSG
SCHEMBL19331341 0.71 ELANE (0.33) ELANECTSG
SCHEMBL2459425 0.70 PDK1 (0.39) HSD17B10GLA

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-8541585-B2 N-acyl cyclic amine derivative or pharmaceutically acceptable salt thereof DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2013-09-24 US disclosed
EP-2545046-A1 N-ACYL CYCLIC AMINE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF Dainippon Sumitomo Pharma Co., Ltd. (JP) 2013-01-16 EP disclosed
US-20120214790-A1 N-ACYL CYCLIC AMINE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF DAINIPPON SUMITOMO PHARMA CO., LTD. 2012-08-23 US disclosed
WO-2011111875-A1 N-ACYL CYCLIC AMINE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-09-15 WO 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-20120214790-A1 N-ACYL CYCLIC AMINE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF GRIN2C, GRIN2A, GRIN2B HSD17B10 340/4885RAB9A 428/4885TSHR 1245/4885

“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.