SCHEMBL8996448

SCHEMBL8996448

Cc1cccc(CC(C)c2cccc(C)c2C)c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.41
PGR P06401 1/20 0.41
NR3C2 P08235 1/20 0.41
ADRA2A P08913 4/20 0.40
ADRA2B P18089 4/20 0.40
ADRA2C P18825 4/20 0.40
ADRA1A P35348 3/20 0.40
ADRA1B P35368 3/20 0.40
ADRA1D P25100 2/20 0.40
TP53 P04637 2/20 0.40
KCNH2 Q12809 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
TSHR P16473 1/20 0.40
CYP2C19 P33261 1/20 0.40
SLC6A2 P23975 1/20 0.39
HTR7 P34969 1/20 0.39
ESR1 P03372 1/20 0.38

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
SCHEMBL6546229 0.91 ADRA2A (0.39) NR3C1PGRNR3C2ADRA2AADRA2B
SCHEMBL2023255 0.84 TSHR (0.53) NR3C1PGRNR3C2TP53TSHR
SCHEMBL1954596 0.84 MAPT (0.49) ADRA2AADRA2BADRA2CADRA1AADRA1B
SCHEMBL1840470 0.82 TRPA1 (0.43) NR3C1PGRNR3C2ADRA2AADRA2B
SCHEMBL1952508 0.82 TRPA1 (0.43) ADRA2AADRA2BADRA2CADRA1AADRA1B
SCHEMBL24733537 0.80 ADRA2A (0.35) NR3C2ADRA2AADRA2BADRA2CADRA1A
SCHEMBL11677650 0.79 GABRA1 (0.56) NR3C1PGRNR3C2TP53ESR1
SCHEMBL6546728 0.79 SIGMAR1 (0.48) CYP2D6SLC6A2TRPA1SCN4A
SCHEMBL6546934 0.79 TAAR1 (0.44) NR3C1PGRNR3C2SLC6A2TRPA1
SCHEMBL1954802 0.77 TRPA1 (0.38) ADRA2AADRA2BADRA2CADRA1AADRA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0508292-B1 Traction drive fluid, process for producing the same and bicyclo octane compound IDEMITSU KOSAN CO (JP) 1996-08-28 EP disclosed
US-5422027-A Drive fluid for rotational elements having a torque transmission relationship comprising a bicyclooctane; low viscosity; broad temperature range; automobile transmissions IDEMITSU KOSAN CO., LTD. (JP) 1995-06-06 US disclosed
US-5283384-A Low viscosity IDEMITSU KOSAN CO., LTD. (JP) 1994-02-01 US disclosed
EP-0508292-A1 Traction drive fluid, process for producing the same and bicyclo octane compound IDEMITSU KOSAN COMPANY LIMITED (JP) 1992-10-14 EP disclosed