SCHEMBL4698515

SCHEMBL4698515

CCOC(C)N1CCN(c2cccc(-n3c(CC(=O)NC)nc4cc(C(=O)O)ccc43)c2)CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.44
THRB P10828 1/20 0.41
HSD17B10 Q99714 1/20 0.39
POLB P06746 1/20 0.38
CRBN Q96SW2 5/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KMT2A Q03164 1/20 0.36
SIRT2 Q8IXJ6 1/20 0.35
SIRT1 Q96EB6 1/20 0.35
PTGER4 P35408 1/20 0.35
ATM Q13315 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 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
SCHEMBL4698489 0.93 HPGD (0.43) HPGDTHRBHSD17B10POLBSMN1; SMN2
SCHEMBL4703176 0.92 THRB (0.44) HPGDTHRBHSD17B10POLBCRBN
SCHEMBL4699188 0.89 THRB (0.42) HPGDTHRBHSD17B10POLBSMN1; SMN2
SCHEMBL4699907 0.89 CRBN (0.44) HPGDTHRBHSD17B10CRBNALDH1A1
SCHEMBL4701536 0.88 THRB (0.43) HPGDTHRBHSD17B10SMN1; SMN2SIRT2
SCHEMBL4702409 0.88 THRB (0.44) HPGDTHRBHSD17B10POLBSMN1; SMN2
SCHEMBL4698571 0.87 THRB (0.41) HPGDTHRBHSD17B10POLBSMN1; SMN2
SCHEMBL4700632 0.85 THRB (0.43) HPGDTHRBHSD17B10POLBSMN1; SMN2
SCHEMBL4702405 0.83 THRB (0.45) HPGDTHRBHSD17B10SMN1; SMN2MEN1
SCHEMBL4698564 0.82 THRB (0.42) HPGDTHRBHSD17B10SMN1; SMN2MEN1

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-1615896-B1 NOVEL BENZIMIDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THESE COMPOUNDS NEUROSEARCH AS (DK) 2008-04-23 EP claimed