SCHEMBL11081985

SCHEMBL11081985

O=C1CCCCc2cccc(O)c21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.53
BAD Q92934 1/20 0.53
MAPT P10636 5/20 0.52
TSHR P16473 3/20 0.52
ALDH1A1 P00352 3/20 0.52
ALOX15 P16050 3/20 0.52
HSD17B10 Q99714 3/20 0.52
TDP1 Q9NUW8 3/20 0.52
USP2 O75604 3/20 0.52
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
CYP3A4 P08684 2/20 0.52
THRB P10828 2/20 0.52
HPN P05981 1/20 0.52
ALOX5 P09917 1/20 0.52
PTGS1 P23219 1/20 0.52
PDE4A P27815 1/20 0.52
KDR P35968 1/20 0.52
SIRT5 Q9NXA8 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL2564157 0.96 MAPT (0.52) BCL2L1BADMAPTTSHRALDH1A1
SCHEMBL668042 0.88 MAPT (0.55) BCL2L1BADMAPTTSHRALDH1A1
SCHEMBL19018589 0.85 BCL2L1 (0.64) BCL2L1BADMAPTTSHRALDH1A1
SCHEMBL34466372 0.78 MAPT (0.50) BCL2L1BADMAPTTSHRALDH1A1
SCHEMBL11610848 0.76 TBXA2R (0.45) BCL2L1BADMAPTTSHRALDH1A1
SCHEMBL12430502 0.76 DYRK1A (0.46) MAPTTSHRMAOAMAOBCYP2A6
SCHEMBL12430503 0.76 SRD5A1 (0.46) BCL2L1BADTSHRKMT2AMEN1
SCHEMBL12430518 0.76 MAOA (0.44) BCL2L1BADTSHRHSD17B10KMT2A
SCHEMBL269511 0.76 BCL2L1 (0.53) BCL2L1BADMAPTTSHRALDH1A1
SCHEMBL12023190 0.75 ALDH1A1 (0.54) BCL2L1BADMAPTTSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4435426-A ADRENERGIC BLOCKING AGENTS, FROM A HYDROXY-KETONE, EPICHLOROHYDRIN AND AN AMINE SOCIETE ANONYME DITE: SANOFI (FR) 1984-03-06 US disclosed