SCHEMBL9848958

SCHEMBL9848958

CC(C)([CH]CCCCc1ccccc1)Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.43
MAOA P21397 1/20 0.42
SLC6A2 P23975 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
SIGMAR1 Q99720 5/20 0.42
MMP8 P22894 2/20 0.41
LMNA P02545 1/20 0.40
CYP2D6 P10635 1/20 0.40
TRPA1 O75762 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
SCHEMBL9214298 0.95 SLC6A2 (0.44) MAOBL3MBTL1MAOASLC6A2TAAR1
Ammonia Solution, Strong SCHEMBL27427966 0.83 DNM1 (0.44) SLC6A2TAAR1SIGMAR1LMNACYP2D6
SCHEMBL7768774 0.80 CHRM2 (0.43) MAOBL3MBTL1MAOASLC6A2SIGMAR1
SCHEMBL9164089 0.76 S1PR1 (0.34) MAOBL3MBTL1TAAR1LMNA
SCHEMBL28157264 0.75 SLC6A2 (0.50) MAOBSLC6A2TAAR1MMP8LMNA
SCHEMBL11253562 0.73 SLC6A2 (0.48) SLC6A2TAAR1MMP8LMNACYP2D6
SCHEMBL5570918 0.73 L3MBTL1 (0.40) MAOBL3MBTL1MAOASLC6A2SIGMAR1
SCHEMBL1478014 0.72 SIGMAR1 (0.52) MAOBL3MBTL1MAOASIGMAR1
SCHEMBL7405977 0.72 GPR52 (0.41) SLC6A2TAAR1
SCHEMBL9560040 0.71 SIGMAR1 (0.55) MAOBL3MBTL1MAOASIGMAR1

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
EP-0411150-A1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-02-06 EP disclosed