SCHEMBL365591

SCHEMBL365591

COc1ccc2c(C(=O)N3CCCCC3)c3ccccc3n2c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.49
HTT P42858 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
ALDH1A1 P00352 2/20 0.46
POLB P06746 2/20 0.45
RAB9A P51151 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CES2 O00748 1/20 0.44
CNR2 P34972 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL367564 0.99 HPGD (0.50) HPGDHTTTDP1LMNASMN1; SMN2
SCHEMBL366310 0.88 ALDH1A1 (0.52) HPGDSMN1; SMN2ALDH1A1POLBRAB9A
SCHEMBL365544 0.88 REN (0.53)
SCHEMBL365014 0.81 KDM4E (0.48) HPGDHTTSMN1; SMN2ALDH1A1POLB
SCHEMBL365590 0.81 KDM4E (0.51) HPGDHTTTDP1LMNASMN1; SMN2
SCHEMBL365565 0.80 KMT2A (0.52) HPGDHTTTDP1LMNASMN1; SMN2
SCHEMBL364594 0.80 EGFR (0.44) HPGDHTTLMNASMN1; SMN2ALDH1A1
SCHEMBL367563 0.79 KDM4E (0.52) HPGDHTTTDP1LMNASMN1; SMN2
SCHEMBL364207 0.78 EGFR (0.47) HPGDHTTSMN1; SMN2ALDH1A1RAB9A
SCHEMBL364969 0.76 KDM4E (0.53) HPGDHTTLMNAALDH1A1POLB

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
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed