SCHEMBL8715352

SCHEMBL8715352

C=Cc1c(CC)ccc2cc3ccccc3cc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.40
CYP2A6 P11509 1/20 0.40
NR1I2 O75469 1/20 0.37
ALDH1A1 P00352 6/20 0.36
HSD17B10 Q99714 3/20 0.36
HIF1A Q16665 1/20 0.36
CYP1B1 Q16678 1/20 0.36
ATM Q13315 1/20 0.36
KDM4E B2RXH2 3/20 0.35
MAPT P10636 3/20 0.35
PKM P14618 3/20 0.35
MEN1 O00255 2/20 0.35
MAPK1 P28482 2/20 0.35
KMT2A Q03164 2/20 0.35
HPGD P15428 2/20 0.35
EGFR P00533 1/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
ALOX12 P18054 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
SCHEMBL8717783 0.87 GPR84 (0.38) CYP1A2CYP2A6NR1I2ALDH1A1HSD17B10
SCHEMBL6402798 0.85 ALDH1A1 (0.35) CYP1A2CYP2A6ALDH1A1HSD17B10HIF1A
SCHEMBL8717051 0.84 TLR8 (0.40) CYP1A2ATMMAPTMEN1KMT2A
SCHEMBL29497335 0.84 TDP1 (0.44) CYP1A2CYP2A6ALDH1A1HSD17B10ATM
SCHEMBL2098306 0.84 TDP1 (0.44) CYP1A2CYP2A6ALDH1A1HSD17B10ATM
SCHEMBL8715524 0.83 TLR8 (0.41) ALDH1A1HSD17B10KDM4EMAPTMEN1
SCHEMBL29266169 0.82 THRA (0.43) ALDH1A1HSD17B10KDM4EMAPTMEN1
SCHEMBL29266155 0.82 THRA (0.43) ALDH1A1HSD17B10KDM4EMAPTMEN1
SCHEMBL8741109 0.82 THRA (0.43) ALDH1A1HSD17B10KDM4EMAPTMEN1
SCHEMBL8718986 0.82 THRA (0.43) ALDH1A1HSD17B10KDM4EMAPTMEN1

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
CN-109906238-A Copolymer rubber and its manufacturing method and crosslinked rubber composition 日铁化学材料株式会社 2019-06-18 CN disclosed
US-RE35773-E SILOXANE-ADDITION POLYMER COMPOSITE NIPPON SHOKUBAI CO., LTD. (JP) 1998-04-21 US disclosed
US-5558803-A ADDITION-CONDENSATION GRAFT COPOLYMERS FOR DIELECTRIC PARTICLES AND INSULATING LIQUIDS NIPPON SHOKUBAI CO., LTD. (JP) 1996-09-24 US disclosed
US-5376294-A A dielectric particle and a polysiloxane/acrylic ester additive in a dielectric dispersant medium; large shear stress and low current density; stability; nonsettling NIPPON SHOKUBAI CO., LTD. (JP) 1994-12-27 US disclosed