SCHEMBL11260165

SCHEMBL11260165

COC(=O)c1cccc2c(-c3ccccc3)nccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 1/20 0.50
SLC40A1 Q9NP59 1/20 0.48
MAPT P10636 2/20 0.47
KDM4E B2RXH2 5/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
AXL P30530 1/20 0.44
POLB P06746 1/20 0.44
ATM Q13315 1/20 0.44
MAP2K1 Q02750 1/20 0.43
MAPK1 P28482 1/20 0.43
MEN1 O00255 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 1/20 0.43
PTGS1 P23219 1/20 0.43
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.42
GLA P06280 1/20 0.42

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
SCHEMBL7649536 0.80 TDP1 (0.59) MAPTKDM4ETDP1ALDH1A1SMN1; SMN2
SCHEMBL23095360 0.79 SLC6A3 (0.48) MAPTKDM4ETDP1ALDH1A1SMN1; SMN2
SCHEMBL16735228 0.78 PSMD14 (0.54) PSMD14SLC40A1MAPTKDM4ETDP1
SCHEMBL70429 0.78 LMNA (0.59) PSMD14MAPTKDM4EALDH1A1POLB
SCHEMBL11445824 0.77 KDM4E (0.40) MAPTKDM4ETDP1ATMMAPK1
SCHEMBL11265967 0.76 ELANE (0.46) MAPTKDM4ETDP1ALDH1A1SMN1; SMN2
SCHEMBL3230050 0.74 NR4A2 (0.53) PSMD14MAPTKDM4EALDH1A1POLB
SCHEMBL69886 0.74 PSMD14 (0.73) PSMD14SLC40A1KDM4ETDP1ALDH1A1
SCHEMBL70381 0.74 BRD4 (0.59) MAPTKDM4EALDH1A1SMN1; SMN2POLB
SCHEMBL29434198 0.74 BRD4 (0.59) MAPTKDM4EALDH1A1SMN1; SMN2POLB

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-4337256-A ANTIINFLAMMATORY AGENTS; ANTIAGGLOMERANTS; ENZYME INHIBITORS; ANTIULCER AGENTS TEIKOKU HORMONE MANUFACTURING CO., LTD. (JP) 1982-06-29 US disclosed
EP-0013411-A1 Isoquinoline derivatives, process for their preparation and pharmaceutical compositions containing them TEIKOKU HORMONE MFG. CO., LTD. (JP) 1980-07-23 EP disclosed