SCHEMBL8970647

SCHEMBL8970647

CCCCCCCCCCCCCCCCC(S(=O)(=O)c1ccc(C)cc1)S(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.50
NR1I2 O75469 1/20 0.45
CA12 O43570 2/20 0.45
CA2 P00918 2/20 0.45
CA9 Q16790 2/20 0.45
ALDH1A1 P00352 6/20 0.45
MMP9 P14780 2/20 0.44
MMP13 P45452 2/20 0.44
ADAM17 P78536 2/20 0.44
MMP1 P03956 2/20 0.44
CYP2C9 P11712 3/20 0.43
CYP2C19 P33261 2/20 0.43
CYP3A4 P08684 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PLA2G2C Q5R387 1/20 0.42
MMP2 P08253 1/20 0.42
MMP3 P08254 1/20 0.42
LMNA P02545 2/20 0.41
TSHR P16473 2/20 0.41
ALB P02768 1/20 0.41

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
SCHEMBL3235417 1.00 MCHR1 (0.50) MCHR1NR1I2CA12CA2CA9
SCHEMBL8971696 1.00 MCHR1 (0.50) MCHR1NR1I2CA12CA2CA9
SCHEMBL8973041 1.00 MCHR1 (0.50) MCHR1NR1I2CA12CA2CA9
SCHEMBL8970696 1.00 MCHR1 (0.50) MCHR1NR1I2CA12CA2CA9
SCHEMBL8971425 1.00 MCHR1 (0.50) MCHR1NR1I2CA12CA2CA9
SCHEMBL7614659 1.00 MCHR1 (0.50) MCHR1NR1I2CA12CA2CA9
SCHEMBL8971220 1.00 MCHR1 (0.50) MCHR1NR1I2CA12CA2CA9
SCHEMBL8971252 1.00 MCHR1 (0.50) MCHR1NR1I2CA12CA2CA9
SCHEMBL8971913 1.00 MCHR1 (0.50) MCHR1NR1I2CA12CA2CA9
SCHEMBL8971451 1.00 MCHR1 (0.50) MCHR1NR1I2CA12CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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