SCHEMBL11275495

SCHEMBL11275495

CC(C)C(C=C(Cl)Cl)C(C(=O)O)(C(C)C)C(C#N)c1cc2ccccc2c(Oc2ccc(Cl)cc2)n1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 9/20 0.33
EGLN1 Q9GZT9 6/20 0.33
CTSS P25774 1/20 0.32
ALDH1A1 P00352 3/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 2/20 0.31
FFAR1 O14842 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
PTGER4 P35408 1/20 0.30
TP53 P04637 1/20 0.30

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
SCHEMBL11272213 0.87 ALDH1A1 (0.33) EGLN2EGLN1ALDH1A1FFAR1LMNA
SCHEMBL11300851 0.76 TDP1 (0.46) EGLN2ALDH1A1MAPTLMNAHPGD
SCHEMBL11275309 0.75 BRAF (0.33) EGLN2EGLN1ALDH1A1KDM4EMAPT
SCHEMBL11299884 0.73 MEN1 (0.33) EGLN2EGLN1LMNAKMT2A
SCHEMBL11276788 0.71 SMN1; SMN2 (0.34) EGLN2EGLN1ALDH1A1KDM4EGAA
SCHEMBL11273014 0.68 PLA2G10 (0.36) EGLN2EGLN1ALDH1A1KDM4ELMNA
SCHEMBL11301973 0.67 TDP1 (0.46) ALDH1A1MAPTFFAR1LMNAHPGD
SCHEMBL11305007 0.67 TDP1 (0.46) ALDH1A1MAPTLMNAHPGDKMT2A
SCHEMBL11301049 0.67 TDP1 (0.44) EGLN2ALDH1A1MAPTLMNAHPGD
SCHEMBL11281949 0.66 PTGS1 (0.31) ALDH1A1FFAR1LMNATDP1

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-4338326-A PESTICIDES UNION CARBIDE CORPORATION (US) 1982-07-06 US disclosed