SCHEMBL23758985

SCHEMBL23758985

Cc1ccc(N(CC(C)C)c2ccccc2)c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA2D1 P54289 1/20 0.37
CACNA1B Q00975 1/20 0.37
CACNB1 Q02641 1/20 0.37
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
POLB P06746 2/20 0.36
RORC P51449 1/20 0.36
APOBEC3A P31941 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
SLC6A2 P23975 3/20 0.35
SLC6A4 P31645 3/20 0.35
TP53 P04637 1/20 0.34
GPR55 Q9Y2T6 1/20 0.33
SLC6A3 Q01959 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL23758983 0.89 POLB (0.37) CACNA2D1CACNA1BCACNB1LMNAMAPT
SCHEMBL23758981 0.85 POLB (0.35) CACNA2D1CACNA1BCACNB1LMNAMAPT
SCHEMBL21969561 0.82 KDM4E (0.41) CACNA2D1CACNA1BCACNB1LMNAMAPT
SCHEMBL23758991 0.82 LMNA (0.33) CACNA2D1CACNA1BCACNB1LMNAMAPT
SCHEMBL22338052 0.81 TP53 (0.44) CACNA2D1CACNA1BCACNB1MAPTNPSR1
SCHEMBL21970159 0.80 ALDH1A1 (0.40) CACNA2D1CACNA1BCACNB1LMNAMAPT
SCHEMBL25886239 0.80 MEN1 (0.34) CACNA2D1CACNA1BCACNB1LMNAMAPT
SCHEMBL15871091 0.79 CYP2C19 (0.46) LMNAALDH1A1POLBAPOBEC3AAPOBEC3G
SCHEMBL18587209 0.79 HTR2A (0.39) CACNA2D1CACNA1BCACNB1LMNAMAPT
SCHEMBL19308370 0.79 HTR2A (0.39) CACNA2D1CACNA1BCACNB1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210355327-A1 CORE-SHELL DYE, PHOTO-SENSITIVE RESIN COMPOSITION COMPRISING SAME, AND COLOR FILTER SAMSUNG SDI CO LTD (KR) 2021-11-18 US disclosed
US-11091645-B2 Core-shell dye, photo-sensitive resin composition comprising same, and color filter SAMSUNG SDI CO., LTD. (KR) 2021-08-17 US disclosed