SCHEMBL31040985

SCHEMBL31040985

c1ccc(Cc2ccc3c(c2)Cc2cc(Cc4ccccc4)ccc2-3)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP11 Q9NR21 1/20 0.54
CALM1 P0DP23 1/20 0.50
IDH1 O75874 1/20 0.48
TSHR P16473 2/20 0.46
ALDH1A1 P00352 2/20 0.46
ATM Q13315 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
PDK2 Q15119 1/20 0.46
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
TP53 P04637 1/20 0.45
MAPK1 P28482 1/20 0.45
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
CYP17A1 P05093 1/20 0.43
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL3974006 0.94 TSHR (0.54) PARP11CALM1IDH1TSHRALDH1A1
SCHEMBL6901227 0.88 CALM1 (0.50) PARP11CALM1IDH1TSHRALDH1A1
SCHEMBL598903 0.88 TSHR (0.58) TSHRALDH1A1ATMNPSR1NPC1
SCHEMBL3982676 0.86 ALDH1A1 (0.47) PARP11CALM1IDH1TSHRALDH1A1
SCHEMBL8910238 0.83 GPR84 (0.49) TSHRALDH1A1ATMNPSR1NPC1
SCHEMBL16721093 0.81 PARP11 (0.43) PARP11CALM1IDH1TSHRALDH1A1
SCHEMBL5675962 0.79 PARP11 (0.50) PARP11CALM1IDH1TSHRALDH1A1
SCHEMBL7182969 0.79 NPC1 (0.52) TSHRALDH1A1ATMNPSR1NPC1
SCHEMBL28375633 0.79 CALM1 (0.44) PARP11CALM1IDH1PDK2HNF4A
SCHEMBL18010818 0.78 TDP2 (0.63) PARP11

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-118420818-B Cycloolefin copolymer, preparation method and application thereof in virtual reality level head-mounted display 拓烯科技(衢州)有限公司 2025-04-29 CN claimed
CN-118420818-A Cycloolefin copolymer, preparation method and application thereof in virtual reality level head-mounted display 拓烯科技(衢州)有限公司 2024-08-02 CN claimed
CN-118420818-B Cycloolefin copolymer, preparation method and application thereof in virtual reality level head-mounted display 拓烯科技(衢州)有限公司 2025-04-29 CN disclosed
CN-118420818-A Cycloolefin copolymer, preparation method and application thereof in virtual reality level head-mounted display 拓烯科技(衢州)有限公司 2024-08-02 CN disclosed