SCHEMBL8399608

SCHEMBL8399608

CCC1CCN(C(=O)OC(C)(C)C)c2cc(C)ccc21

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.43
KDM1A O60341 1/20 0.41
LMNA P02545 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
GAA P10253 1/20 0.40
ALOX12 P18054 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KMT2A Q03164 4/20 0.38
MAPT P10636 3/20 0.38
MEN1 O00255 3/20 0.38
TP53 P04637 2/20 0.37
EPHX2 P34913 1/20 0.37
TSHR P16473 1/20 0.36
GRM5 P41594 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL8878473 0.86 ALDH1A1 (0.43) GPR119KDM1AKMT2AMEN1EPHX2
SCHEMBL8878468 0.86 ALDH1A1 (0.43) GPR119KDM1AKMT2AMEN1EPHX2
SCHEMBL6650959 0.86 ALDH1A1 (0.43) GPR119KDM1AKMT2AMEN1EPHX2
SCHEMBL13091175 0.82 NOTUM (0.48) LMNAGAAALOX12SMN1; SMN2KMT2A
SCHEMBL6649701 0.79 ALDH1A1 (0.43) GPR119KDM1AKMT2AMEN1EPHX2
SCHEMBL19791975 0.76 KDM1A (0.47) GPR119KDM1ALMNANPSR1KMT2A
SCHEMBL3733255 0.74 PDE4A (0.42) GPR119KDM1ASMN1; SMN2MAPT
SCHEMBL12341085 0.74 PDE4A (0.42) GPR119KDM1ASMN1; SMN2MAPT
SCHEMBL23063860 0.73 DRD2 (0.52) GPR119KDM1ALMNANPSR1SMN1; SMN2
SCHEMBL22868066 0.73 KDM4E (0.41) GPR119KDM1ALMNANPSR1KMT2A

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
US-5994544-A PRODUCING A 5H-CHROMENO(3,4-F)QUINOLINE LIGAND PHARMACEUTICALS INCORPORATED (US) 1999-11-30 US disclosed