SCHEMBL9212129

SCHEMBL9212129

CCCCCCCNC(=O)c1oc(-c2ccc(CCC)cc2)c2cc(C)ccc12

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
HPGD P15428 2/20 0.45
TP53 P04637 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.39
PLK1 P53350 7/20 0.39
PLK3 Q9H4B4 2/20 0.39
GFER P55789 1/20 0.39
NAAA Q02083 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL9212406 0.92 L3MBTL1 (0.53) L3MBTL1HPGDTP53SMN1; SMN2ALDH1A1
SCHEMBL9213695 0.88 L3MBTL1 (0.46) L3MBTL1HPGDTP53SMN1; SMN2ALDH1A1
SCHEMBL9219551 0.88 L3MBTL1 (0.46) L3MBTL1HPGDTP53SMN1; SMN2ALDH1A1
SCHEMBL9220347 0.88 NAAA (0.49) L3MBTL1HPGDSMN1; SMN2ALDH1A1LMNA
SCHEMBL9218058 0.87 L3MBTL1 (0.44) L3MBTL1HPGDTP53ALDH1A1TSHR
SCHEMBL9212117 0.82 TP53 (0.51) L3MBTL1HPGDTP53SMN1; SMN2ALDH1A1
SCHEMBL9216023 0.82 L3MBTL1 (0.54) L3MBTL1HPGDTP53SMN1; SMN2ALDH1A1
SCHEMBL9209891 0.81 HPGD (0.45) HPGDTP53ALDH1A1TSHR
SCHEMBL9213874 0.81 LDHA (0.43) HPGDTP53SMN1; SMN2ALDH1A1PLK1
SCHEMBL9216814 0.81 NAAA (0.50) HPGDALDH1A1NAAA

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-0512570-B1 Urea derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1995-10-11 EP disclosed
EP-0512570-A1 Urea derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-11-11 EP disclosed