SCHEMBL30368601

SCHEMBL30368601

Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccccc3-c3ccc(N(c4ccc(C)cc4)c4ccc(C)cc4)cc3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
TSHR P16473 2/20 0.42
RAB9A P51151 4/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
NPC1 O15118 3/20 0.42
CYP2C19 P33261 2/20 0.41
CES1 P23141 1/20 0.40
PTAFR P25105 1/20 0.39
POLB P06746 1/20 0.39
LTB4R2 Q9NPC1 1/20 0.39
TDP1 Q9NUW8 3/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPT P10636 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 2/20 0.38

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
SCHEMBL403423 0.98 ALDH1A1 (0.41) ALDH1A1TSHRRAB9AMEN1KMT2A
SCHEMBL22079686 0.94 HPRT1 (0.45) ALDH1A1TSHRRAB9AMEN1KMT2A
SCHEMBL22079954 0.94 HPRT1 (0.45) ALDH1A1TSHRRAB9AMEN1KMT2A
SCHEMBL20086814 0.94 TDP1 (0.43) ALDH1A1TSHRRAB9AMEN1KMT2A
SCHEMBL13135372 0.94 ALDH1A1 (0.43) ALDH1A1TSHRRAB9AMEN1KMT2A
SCHEMBL20086819 0.94 HPRT1 (0.45) ALDH1A1TSHRRAB9AMEN1KMT2A
SCHEMBL18801418 0.92 HPRT1 (0.44) ALDH1A1TSHRRAB9AMEN1KMT2A
SCHEMBL15681405 0.90 CA12 (0.46) ALDH1A1TSHRRAB9AMEN1KMT2A
SCHEMBL12636524 0.89 NPC1 (0.43) ALDH1A1TSHRRAB9AMEN1KMT2A
SCHEMBL2258241 0.88 MEN1 (0.38) ALDH1A1TSHRRAB9AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116018002-A OLED light-emitting device, preparation process thereof and full-color OLED device 江苏三月科技股份有限公司 2023-04-25 CN disclosed