SCHEMBL8775740

SCHEMBL8775740

CC=COC1=C(O)[C@H](CC/C=C\CCCCCCCCCCCCCC)OC1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABHD16A O95870 1/20 0.40
PTPN1 P18031 5/20 0.37
CDC25B P30305 4/20 0.37
ACP1 P24666 3/20 0.37
MAPT P10636 3/20 0.37
RECQL P46063 2/20 0.37
DUSP3 P51452 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
PTPN2 P17706 1/20 0.37
HPSE Q9Y251 1/20 0.37
CES2 O00748 1/20 0.36
CDC25A P30304 1/20 0.36
CDC25C P30307 1/20 0.36
PPARG P37231 3/20 0.36
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
FAAH O00519 3/20 0.34
TRPV1 Q8NER1 1/20 0.34
TERT O14746 3/20 0.34
BLM P54132 2/20 0.34

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
SCHEMBL8775325 1.00 ABHD16A (0.40) ABHD16APTPN1CDC25BACP1MAPT
SCHEMBL8775746 1.00 ABHD16A (0.40) ABHD16APTPN1CDC25BACP1MAPT
SCHEMBL8775330 1.00 ABHD16A (0.40) ABHD16APTPN1CDC25BACP1MAPT
SCHEMBL8775096 1.00 ABHD16A (0.40) ABHD16APTPN1CDC25BACP1MAPT
SCHEMBL8775334 1.00 ABHD16A (0.40) ABHD16APTPN1CDC25BACP1MAPT
SCHEMBL8775338 1.00 ABHD16A (0.40) ABHD16APTPN1CDC25BACP1MAPT
SCHEMBL8990008 0.95 TRPV1 (0.39) ABHD16AMAPTRECQLTDP1PPARG
SCHEMBL8990022 0.95 TRPV1 (0.39) ABHD16AMAPTRECQLTDP1PPARG
SCHEMBL8775592 0.95 TRPV1 (0.39) ABHD16AMAPTRECQLTDP1PPARG
SCHEMBL8775215 0.95 TRPV1 (0.39) ABHD16AMAPTRECQLTDP1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0804430-A1 SYNTHESIS OF OPTICALLY PURE 4-ALKENYL- OR 4-ALKANYL-2-HYDROXYTETRONIC ACIDS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1997-11-05 EP disclosed
US-5656662-A TREATING OR PREVENTING ATHEROSCLEROTIC DISORDERS, INHIBITING INFLAMMATORY CYTOKINES THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1997-08-12 US disclosed
WO-1995032194-A1 SYNTHESIS OF OPTICALLY PURE 4-ALKENYL- OR 4-ALKANYL-2-HYDROXYTETRONIC ACIDS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1995-11-30 WO disclosed