SCHEMBL9968091

SCHEMBL9968091

CCC(C)(C)c1ccc2c(n1)c1ccccc1n2C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.44
PTGER4 P35408 2/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
LMNA P02545 2/20 0.42
GABRP O00591 1/20 0.40
GABRD O14764 1/20 0.40
GABRA1 P14867 1/20 0.40
GABRB1 P18505 1/20 0.40
GABRG2 P18507 1/20 0.40
GABRB3 P28472 1/20 0.40
GABRA5 P31644 1/20 0.40
GABRA3 P34903 1/20 0.40
GABRA2 P47869 1/20 0.40
GABRB2 P47870 1/20 0.40
GABRA4 P48169 1/20 0.40
GABRE P78334 1/20 0.40
GABRA6 Q16445 1/20 0.40
GABRG1 Q8N1C3 1/20 0.40
GABRG3 Q99928 1/20 0.40
GABRQ Q9UN88 1/20 0.40

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
SCHEMBL9968067 0.84 GPR3 (0.50) GPR3PTGER4L3MBTL1LMNAGABRP
SCHEMBL9968186 0.78 PTGER4 (0.35) PTGER4L3MBTL1LMNAMAPTTSHR
SCHEMBL9968096 0.76 GPR3 (0.44) GPR3PTGER4L3MBTL1LMNAGABRP
SCHEMBL16625728 0.74 GPR3 (0.54) GPR3PTGER4L3MBTL1LMNAGABRP
SCHEMBL12652954 0.72 PTGER4 (0.64) GPR3PTGER4L3MBTL1LMNAGABRP
SCHEMBL9968158 0.72 GPR3 (0.52) GPR3L3MBTL1LMNAMAPTMAPK1
SCHEMBL23373469 0.70 GPR3 (0.53) GPR3PTGER4L3MBTL1LMNAGABRP
SCHEMBL20808035 0.70 L3MBTL1 (0.41) L3MBTL1LMNAMAPTTSHRALOX15
SCHEMBL21467589 0.70 LMNA (0.39) L3MBTL1LMNAMAPTTSHRPOLB
SCHEMBL9968116 0.70 PRNP (0.45) GPR3PTGER4L3MBTL1LMNAGABRP

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-20120153817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-06-21 US disclosed
US-20120153817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-06-21 US disclosed