SCHEMBL8970741

SCHEMBL8970741

CCCC(C)Oc1ccc(C=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A3 P47895 2/20 0.61
DRD1 P21728 1/20 0.47
ALDH1A1 P00352 6/20 0.47
CYP2A6 P11509 2/20 0.47
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
TYR P14679 1/20 0.42
ALDH3A1 P30838 1/20 0.40
KMT2A Q03164 2/20 0.39
STS P08842 1/20 0.38
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
LTB4R Q15722 1/20 0.36
LTB4R2 Q9NPC1 1/20 0.36
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 1/20 0.36
GPR88 Q9GZN0 1/20 0.35
PARP10 Q53GL7 1/20 0.35

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
SCHEMBL11789545 1.00 ALDH1A3 (0.61) ALDH1A3DRD1ALDH1A1CYP2A6LMNA
SCHEMBL4049963 0.88 RAB9A (0.49) ALDH1A3DRD1ALDH1A1LMNASMN1; SMN2
SCHEMBL10624640 0.87 ALDH1A3 (0.54) ALDH1A3DRD1ALDH1A1CYP2A6LMNA
SCHEMBL11442565 0.87 ALDH1A3 (0.54) ALDH1A3DRD1ALDH1A1CYP2A6LMNA
SCHEMBL16353393 0.85 ALDH1A3 (0.66) ALDH1A3DRD1ALDH1A1CYP2A6LMNA
SCHEMBL1915714 0.84 ALDH1A3 (0.58) ALDH1A3DRD1ALDH1A1CYP2A6LMNA
SCHEMBL11759441 0.83 ALDH1A3 (0.58) ALDH1A3DRD1ALDH1A1CYP2A6LMNA
SCHEMBL3032255 0.82 TAS1R3 (0.43) ALDH1A3ALDH1A1KMT2ATAS1R3TAS1R1
SCHEMBL18323986 0.82 ALDH1A3 (0.39) ALDH1A3DRD1LMNASMN1; SMN2KMT2A
SCHEMBL21982965 0.81 ALDH1A3 (0.56) ALDH1A3DRD1ALDH1A1CYP2A6LMNA

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
EP-2062882-B1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND, POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, AND ALIGNMENT FILM NISSAN CHEMICAL IND LTD (JP) 2011-09-28 EP disclosed
EP-0493601-B1 LIQUID-CRYSTAL COPOLYMER, PRODUCTION THEREOF, DIENE COMPOUND USED IN SAID PRODUCTION, AND PRODUCTION OF SAID COMPOUND IDEMITSU KOSAN CO (JP) 1996-03-20 EP disclosed
US-5425897-A Electrooptics IDEMITSU KOSAN CO., LTD. (JP) 1995-06-20 US disclosed
US-5380915-A Copolymers of polydimethylsiloxane with diene ethers IDEMITSU KOSAN CO., LTD. (JP) 1995-01-10 US disclosed
US-5281685-A Polyether pendant groups, polysiloxane repeating units IDEMITSU KOSAN CO., LTD. (JP) 1994-01-25 US disclosed
EP-0493601-A1 LIQUID-CRYSTAL COPOLYMER, PRODUCTION THEREOF, DIENE COMPOUND USED IN SAID PRODUCTION, AND PRODUCTION OF SAID COMPOUND IDEMITSU KOSAN COMPANY LIMITED (JP) 1992-07-08 EP disclosed