SCHEMBL9664878

SCHEMBL9664878

CCCCCCCCCCCCOC(=O)c1ccc(OC(C)=O)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.66
ALDH1A1 P00352 2/20 0.66
NPC1 O15118 2/20 0.66
RAB9A P51151 1/20 0.66
STS P08842 7/20 0.64
HPGD P15428 2/20 0.63
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63
LMNA P02545 3/20 0.62
CYP1A2 P05177 2/20 0.62
TSHR P16473 2/20 0.62
CYP2C19 P33261 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
ESR1 P03372 1/20 0.62
CYP2D6 P10635 1/20 0.62
MAPK1 P28482 1/20 0.62
NR1H2 P55055 1/20 0.62
RNASEL Q05823 1/20 0.62
CYP3A4 P08684 1/20 0.60
CYP2C9 P11712 1/20 0.60

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
SCHEMBL8197525 1.00 MAPT (0.66) MAPTALDH1A1NPC1RAB9ASTS
SCHEMBL9650912 0.97 MAPT (0.67) MAPTALDH1A1NPC1RAB9ASTS
SCHEMBL516632 0.95 ESR1 (0.68) MAPTALDH1A1NPC1RAB9ASTS
SCHEMBL9446681 0.94 LMNA (0.56) MAPTALDH1A1NPC1RAB9ASTS
SCHEMBL9446645 0.92 LMNA (0.57) MAPTALDH1A1NPC1RAB9ASTS
SCHEMBL15165085 0.92 MAPT (0.57) MAPTALDH1A1NPC1RAB9ASTS
SCHEMBL10423327 0.91 LMNA (0.62) MAPTALDH1A1NPC1RAB9ASTS
SCHEMBL19373812 0.91 MAPT (0.74) MAPTALDH1A1NPC1RAB9ASTS
SCHEMBL10344104 0.91 MAPT (0.74) MAPTALDH1A1NPC1RAB9ASTS
SCHEMBL19373809 0.91 MAPT (0.74) MAPTALDH1A1NPC1RAB9ASTS

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-0313379-B1 OPTICALLY ACTIVE COMPOUND HAVING DELTA-VALEROLACTONE RING AND LIQUID CRYSTAL COMPOSITION COMPRISING SAME MITSUBISHI RAYON CO., LTD. (JP) 1992-07-22 EP disclosed
US-5045228-A Useful for high speed print heads MITSUBISHI RAYON COMPANY LTD. (JP) 1991-09-03 US disclosed
EP-0313379-A2 Optically active compound having delta-valerolactone ring and liquid crystal composition comprising same MITSUBISHI RAYON CO., LTD. (JP) 1989-04-26 EP disclosed