SCHEMBL9218346

SCHEMBL9218346

Cc1ccc2c(-c3ccc(Cl)cc3)c(CNCc3ccccc3)oc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.53
POLB P06746 1/20 0.43
CYP19A1 P11511 1/20 0.41
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
MAPT P10636 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
MMP2 P08253 1/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
XBP1 P17861 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PTPN1 P18031 2/20 0.38
TP53 P04637 2/20 0.38
ALDH1A1 P00352 1/20 0.38
THRB P10828 1/20 0.37
NR1H4 Q96RI1 1/20 0.36

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
SCHEMBL9431302 0.91 L3MBTL1 (0.49) NPC1CYP19A1ESR1ESR2MAPT
Hydrochloric Acid SCHEMBL9213805 0.90 L3MBTL1 (0.48) NPC1CYP19A1MAPTL3MBTL1MMP2
Hydrochloric Acid SCHEMBL9220707 0.85 L3MBTL1 (0.43) NPC1MAPTL3MBTL1MMP2MEN1
SCHEMBL9431764 0.83 L3MBTL1 (0.43) NPC1POLBMAPTL3MBTL1MMP2
SCHEMBL9221219 0.83 CA1 (0.43) CYP19A1ESR1ESR2MEN1KMT2A
SCHEMBL9430278 0.82 BCHE (0.50) NPC1MEN1KMT2APTPN1
Hydrochloric Acid SCHEMBL9216724 0.82 L3MBTL1 (0.42) NPC1POLBMAPTL3MBTL1MEN1
Hydrochloric Acid SCHEMBL9215520 0.82 L3MBTL1 (0.52) NPC1POLBMAPTL3MBTL1MMP2
SCHEMBL9430879 0.82 L3MBTL1 (0.42) NPC1MAPTL3MBTL1MEN1KMT2A
Hydrochloric Acid SCHEMBL9221124 0.80 L3MBTL1 (0.48) MAPTL3MBTL1MEN1KMT2ASMN1; SMN2

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