SCHEMBL9215682

SCHEMBL9215682

CCCCCCCNC(=O)c1oc2ccccc2c1-c1ccc(Cl)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 1/20 0.47
NAAA Q02083 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
HPGD P15428 1/20 0.42
ALOX15 P16050 2/20 0.41
TP53 P04637 2/20 0.41
CNR1 P21554 1/20 0.41
PTGS2 P35354 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
EPHX1 P07099 3/20 0.41
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL9220873 0.88 EPHX1 (0.49) HDAC1HDAC2NAAAALOX15MAPK1
SCHEMBL9219835 0.88 TP53 (0.53) HDAC1HDAC2NAAANPC1RAB9A
SCHEMBL9212465 0.86 HDAC1 (0.54) HDAC1HDAC2NAAANPC1RAB9A
SCHEMBL9216012 0.85 TP53 (0.55) HDAC1HDAC2NAAANPC1RAB9A
SCHEMBL9222006 0.84 HDAC1 (0.51) HDAC1HDAC2NAAANPC1RAB9A
SCHEMBL9218992 0.84 HDAC1 (0.50) HDAC1HDAC2NAAANPC1RAB9A
SCHEMBL9215701 0.83 NAAA (0.45) NAAANPC1RAB9AHPGDALOX15
SCHEMBL9218736 0.80 NAAA (0.47) HDAC1HDAC2NAAAHPGDALOX15
SCHEMBL9216809 0.80 NAAA (0.49) HDAC1HDAC2NAAAHPGDALOX15
SCHEMBL9210110 0.78 HDAC1 (0.56) HDAC1HDAC2NAAANPC1RAB9A

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