SCHEMBL20548576

SCHEMBL20548576

C1=Cc2c(ccc3ccccc23)C2C1=Cc1ccccc12

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 1/20 0.38
KDM1A O60341 1/20 0.37
ALDH1A1 P00352 4/20 0.33
HSD17B10 Q99714 3/20 0.33
CYP2A6 P11509 2/20 0.33
TSHR P16473 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
HPGD P15428 2/20 0.32
CYP3A4 P08684 1/20 0.32
KEAP1 Q14145 1/20 0.32
HPRT1 P00492 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
RCE1 Q9Y256 1/20 0.31
KDM4E B2RXH2 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
CYP1A2 P05177 1/20 0.30

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
SCHEMBL22973399 0.78 CES1 (0.35) P2RX4KDM1AALDH1A1HSD17B10CYP2A6
SCHEMBL5477612 0.67 KDM1A (0.44) KDM1AALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL7939732 0.67 IDO1 (0.39) ALDH1A1HSD17B10HPGDKDM4E
SCHEMBL15880309 0.67 ALDH1A1 (0.31) P2RX4ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL2267122 0.67 ALDH1A1 (0.35) ALDH1A1HSD17B10TSHRTDP1HPGD
SCHEMBL7651339 0.66 HSD17B10 (0.39) KDM1AALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL6671899 0.65 HTR2A (0.31)
Hydrochloric Acid SCHEMBL7937366 0.64 HSD17B10 (0.37) KDM1AALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL987554 0.64 ALDH1A1 (0.34) P2RX4KDM1AALDH1A1HSD17B10CYP2A6
SCHEMBL6545899 0.63 ALDH1A1 (0.52) P2RX4ALDH1A1HSD17B10CYP2A6TSHR

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-3399368-B1 LAMINATE AND OPTICAL ARTICLE USING SAID LAMINATE TOKUYAMA CORP (JP) 2021-02-24 EP disclosed
US-10690943-B2 Laminate and optical article comprising the same TOKUYAMA CORPORATION (JP) 2020-06-23 US disclosed
US-20190004336-A1 LAMINATE AND OPTICAL ARTICLE COMPRISING THE SAME TOKUYAMA CORPORATION (JP) 2019-01-03 US disclosed
EP-3399368-A1 LAMINATE AND OPTICAL ARTICLE USING SAID LAMINATE Tokuyama Corporation (JP) 2018-11-07 EP disclosed