SCHEMBL7093086

SCHEMBL7093086

Cc1c[nH]c2cc(C(=O)c3ccc4ccccc4c3NCC(=O)N3CCC(CN4CCCCC4)CC3)ccc12

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.40
GAA P10253 1/20 0.39
KDM2B Q8NHM5 4/20 0.38
MAPT P10636 7/20 0.38
LMNA P02545 2/20 0.37
THRB P10828 2/20 0.36
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35

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
SCHEMBL7092866 0.88 ACHE (0.42) F10GAAKDM2BMAPTLMNA
SCHEMBL7097521 0.84 F10 (0.42) F10CHRM2CHRM4CHRM1CHRM3
SCHEMBL7098239 0.82 F10 (0.42) F10GAAMAPTLMNATHRB
SCHEMBL7092545 0.81 MAPT (0.42) F10GAAMAPTLMNATHRB
SCHEMBL7139465 0.79 MAPT (0.40) F10GAAMAPTLMNATHRB
SCHEMBL6424181 0.77 F10 (0.39) F10GAAKDM2BMAPTLMNA
SCHEMBL7092571 0.73 F10 (0.42) F10MAPT
Hydrochloric Acid SCHEMBL6420510 0.73 F10 (0.43) F10GAAMAPTLMNATHRB
SCHEMBL6421346 0.72 MAPT (0.40) F10GAAMAPTLMNATHRB
SCHEMBL7098081 0.71 ACHE (0.41) GAAMAPTLMNATHRB

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
EP-1289953-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2003-03-12 EP disclosed
WO-2001096304-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2001-12-20 WO disclosed