SCHEMBL11235233

SCHEMBL11235233

CNC(=O)c1ccc2c(c1)OOC2

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.42
HDAC6 Q9UBN7 2/20 0.42
HDAC2 Q92769 1/20 0.42
PLAU P00749 1/20 0.41
CRBN Q96SW2 2/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PLK1 P53350 5/20 0.39
THRB P10828 1/20 0.38
PRF1 P14222 1/20 0.38
ROCK2 O75116 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL11841323 0.87 HDAC8 (0.42) HDAC8HDAC6HDAC2PLAUCRBN
SCHEMBL5098817 0.81 NPC1 (0.50) MEN1KMT2AHPGDNPC1RAB9A
SCHEMBL9709462 0.80 MEN1 (0.42) MEN1LMNAKMT2AHPGDTSHR
SCHEMBL9436947 0.80 CTNNB1 (0.41) HPGDTSHR
SCHEMBL11215650 0.80 ALDH1A1 (0.50) MEN1GAAKMT2ATSHR
SCHEMBL1826388 0.79 HTR1B (0.48) MEN1GAAKMT2AHPGDSMN1; SMN2
SCHEMBL2788305 0.79 KDM4E (0.59) HPGDSMN1; SMN2ROCK2NPC1RAB9A
SCHEMBL5944024 0.78 ALDH1A1 (0.33) TSHRNPC1RAB9A
SCHEMBL11320077 0.77 CPT1B (0.38) MEN1KMT2ATSHRNPC1RAB9A
SCHEMBL8961620 0.74 MEN1 (0.50) MEN1LMNAKMT2AHPGDHTT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4342875-A STABILIZERS FOR OLEFIN POLYMERS CINCINNATI-MILACRON, INC. (US) 1982-08-03 US disclosed