SCHEMBL864567

SCHEMBL864567

CCOC(=O)C1CN2CCCCC2CC1=O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 13/20 0.45
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
POLB P06746 2/20 0.45
LMNA P02545 1/20 0.42
MAPT P10636 2/20 0.41
MAPK1 P28482 1/20 0.41
TSHR P16473 2/20 0.40
TLR4 O00206 1/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL19349885 0.85 ALDH1A1 (0.38) ALDH1A1KMT2APOLBSMN1; SMN2
SCHEMBL9831077 0.82 ALDH1A1 (0.47) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL9833333 0.81 ALDH1A1 (0.49) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL857668 0.80 BRD4 (0.37) ALDH1A1MEN1KMT2APOLBGAA
SCHEMBL6922615 0.80 BRD4 (0.37) ALDH1A1MEN1KMT2APOLBGAA
SCHEMBL19362428 0.79 ALDH1A1 (0.40) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL11568317 0.79 MAPT (0.43) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL19360209 0.79 ALDH1A1 (0.53) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL19349842 0.79 ALDH1A1 (0.45) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL19360216 0.78 ALDH1A1 (0.42) ALDH1A1MEN1KMT2APOLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170267679-A1 TRICYCLIC FUSED PYRIMIDINE COMPOUNDS AS INHIBITORS OF p97 COMPLEX CLEAVE BIOSCIENCES INC (US) 2017-09-21 US disclosed
EP-2440563-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF Sunovion Pharmaceuticals Inc. (US) 2012-04-18 EP disclosed
US-20120077802-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2012-03-29 US disclosed
US-20120077802-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2012-03-29 US disclosed
WO-2010144571-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF SEPRACOR INC. (US) 2010-12-16 WO disclosed
WO-2010144571-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF SEPRACOR INC. (US) 2010-12-16 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 (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-20170267679-A1 TRICYCLIC FUSED PYRIMIDINE COMPOUNDS AS INHIBITORS OF p97 COMPLEX PSMG3, PSME1, PSMB3 ALDH1A1 3234/4885MEN1 4042/4885KMT2A 2831/4885
US-20120077802-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF HRH3, HRH4, HRH2 ALDH1A1 1972/4885MEN1 1150/4885KMT2A 559/4885

“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.