SCHEMBL7149795

SCHEMBL7149795

O=C(Cc1ccccc1)NCc1ccc(N2CCCCC2=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.57
MAPT P10636 3/20 0.56
CDK2 P24941 2/20 0.56
LMNA P02545 4/20 0.56
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
HPGD P15428 2/20 0.55
ALDH1A1 P00352 3/20 0.55
METTL3 Q86U44 1/20 0.54
METTL14 Q9HCE5 1/20 0.54
RAB9A P51151 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
POLB P06746 1/20 0.53
BLM P54132 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
TSHR P16473 1/20 0.53
TP53 P04637 1/20 0.53
NAMPT P43490 1/20 0.51
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50

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
SCHEMBL7148309 0.85 MAPT (0.68) USP2MAPTCDK2MEN1KMT2A
SCHEMBL7153529 0.84 NPC1 (0.69) USP2MAPTCDK2MEN1KMT2A
SCHEMBL23013358 0.81 USP2 (0.68) USP2MAPTLMNAMEN1KMT2A
SCHEMBL7154056 0.81 ALDH1A1 (0.66) USP2MAPTCDK2MEN1KMT2A
SCHEMBL1675926 0.80 USP2 (0.67) USP2MAPTLMNAMEN1KMT2A
SCHEMBL6788342 0.80 ALDH1A1 (0.61) USP2MAPTCDK2LMNAMEN1
SCHEMBL7151978 0.77 CDK2 (0.61) USP2MAPTCDK2LMNAMEN1
SCHEMBL5124270 0.77 ALDH1A1 (0.66) USP2MAPTLMNAMEN1KMT2A
SCHEMBL392625 0.76 ALDH1A1 (0.82) MAPTLMNAMEN1KMT2AHPGD
SCHEMBL7088328 0.76 MAPT (0.68) MAPTLMNAMEN1KMT2AALDH1A1

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-1351938-A1 PHENYL DERIVATIVES MERCK PATENT GmbH (DE) 2003-10-15 EP disclosed
WO-2002057236-A1 PHENYL DERIVATIVES MERCK PATENT GMBH (DE) 2002-07-25 WO disclosed