SCHEMBL11261342

SCHEMBL11261342

CC(C)c1nccc2c(CCl)cccc12

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
PSMD14 O00487 1/20 0.32
COPS5 Q92905 1/20 0.32
LMNA P02545 2/20 0.31
KDM4E B2RXH2 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
ALOX12 P18054 1/20 0.31
LOXL2 Q9Y4K0 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL11257657 0.84 LMNA (0.46) GABRA1GABRB2PSMD14COPS5LMNA
SCHEMBL11250074 0.83 LOXL2 (0.49) GABRA1GABRB2PSMD14COPS5LMNA
SCHEMBL7358290 0.80 DPP4 (0.33) KDM4EMAPTTSHRMEN1KMT2A
SCHEMBL11258743 0.79 ALDH1A1 (0.32) GABRA1GABRB2
SCHEMBL11261355 0.78 TDP1 (0.50) KDM4EMAPT
SCHEMBL20009335 0.77 CYP1A2 (0.50) PSMD14COPS5LMNAKDM4EMAPT
SCHEMBL11267468 0.74 ANPEP (0.38) MAPTMEN1KMT2A
SCHEMBL28538582 0.74 LMNA (0.41) GABRA1GABRB2LMNATSHR
SCHEMBL13051656 0.74 GABRA1 (0.40) GABRA1GABRB2PSMD14COPS5LMNA
SCHEMBL11255746 0.74 ALDH1A1 (0.40) LMNAKDM4EMEN1KMT2A

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