SCHEMBL11667347

SCHEMBL11667347

C/C(=C\C=O)CC/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.59
KDM1A O60341 1/20 0.57
ALDH1A1 P00352 1/20 0.50
PTGS1 P23219 1/20 0.44
PDE4A P27815 1/20 0.44
SNCA P37840 1/20 0.44
PDE3A Q14432 1/20 0.44
PTPN2 P17706 1/20 0.40
CDC25B P30305 1/20 0.40
LMNA P02545 1/20 0.38
BLM P54132 1/20 0.38

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
SCHEMBL11667351 1.00 PTPN1 (0.59) PTPN1KDM1AALDH1A1PTGS1PDE4A
SCHEMBL29663830 0.94 KDM1A (0.64) PTPN1KDM1AALDH1A1
SCHEMBL8735440 0.94 KDM1A (0.64) PTPN1KDM1AALDH1A1
SCHEMBL10411567 0.91 PTPN1 (0.61) PTPN1KDM1AALDH1A1PTGS1PDE4A
SCHEMBL10411568 0.91 PTPN1 (0.61) PTPN1KDM1AALDH1A1PTGS1PDE4A
SCHEMBL31211760 0.91 PTPN1 (0.61) PTPN1KDM1AALDH1A1PTGS1PDE4A
SCHEMBL13277591 0.91 PTPN1 (0.61) PTPN1KDM1AALDH1A1PTGS1PDE4A
SCHEMBL214389 0.91 PTPN1 (0.61) PTPN1KDM1AALDH1A1PTGS1PDE4A
SCHEMBL13277590 0.91 PTPN1 (0.61) PTPN1KDM1AALDH1A1PTGS1PDE4A
SCHEMBL214388 0.91 PTPN1 (0.61) PTPN1KDM1AALDH1A1PTGS1PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4105697-A Process for the preparation of α, β-ethylenic aldehydes RHONE-POULENC INDUSTRIES (FR) 1978-08-08 US disclosed
US-3978092-A Process for the preparation of unsaturated carbonyl compounds TEIJIN LIMITED (JA) 1976-08-31 US disclosed