SCHEMBL21475985

SCHEMBL21475985

CC1(C)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cc(-n2c3ccccc3c3cc4c(cc32)-c2ccccc2C4(C)C)nc(-c2ccccc2)n1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.35
MAPT P10636 2/20 0.31
TSHR P16473 2/20 0.31
MAPK1 P28482 2/20 0.31
HSD17B10 Q99714 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 1/20 0.30
LMNA P02545 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
SCHEMBL25966269 1.00 HTT (0.35) HTTMAPTTSHRMAPK1HSD17B10
SCHEMBL26287217 0.95 HTT (0.35) HTTMAPTTSHRMAPK1HSD17B10
SCHEMBL2603585 0.95 MAPT (0.39) HTTMAPTTSHRMAPK1HSD17B10
SCHEMBL14731161 0.90 MAPT (0.39) HTTMAPTTSHRMAPK1HSD17B10
SCHEMBL25966265 0.90 MAPT (0.35) MAPTTSHRMAPK1HSD17B10NPSR1
SCHEMBL31853 0.90 L3MBTL1 (0.32) MAPT
SCHEMBL2603576 0.90 ABCG2 (0.30)
SCHEMBL25966261 0.89 MAPT (0.33) MAPTTSHRMAPK1HSD17B10NPSR1
SCHEMBL2603605 0.89 MAPT (0.33) MAPTTSHRMAPK1HSD17B10NPSR1
SCHEMBL25966210 0.88 HTT (0.36) HTTMAPTTSHRMAPK1HSD17B10

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
US-10978642-B2 Mixture, composition and organic electronic device GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2021-04-13 US disclosed
US-20200098992-A1 MIXTURE, COMPOSITION AND ORGANIC ELECTRONIC DEVICE GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2020-03-26 US disclosed
US-20190355911-A1 ORGANIC MIXTURE, ORGANIC COMPOSITION, ORGANIC ELECTRONIC COMPONENT AND PREPARATION METHOD THEREFOR GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2019-11-21 US disclosed
EP-3553152-A1 MIXTURE, COMPOSITION AND ORGANIC ELECTRONIC DEVICE Guangzhou Chinaray Optoelectronic Materials Ltd. (CN) 2019-10-16 EP disclosed