SCHEMBL18697204

SCHEMBL18697204

CC1(C)CC2(CC(=O)N(c3ccccc3)C(=O)O2)CC(C)(C)N1Oc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
HSD11B1 P28845 1/20 0.33
HPGD P15428 2/20 0.32
LMNA P02545 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CTSV O60911 1/20 0.32
CTSL P07711 1/20 0.32
CTSB P07858 1/20 0.32
CTSH P09668 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
CTSC P53634 1/20 0.32
CTSF Q9UBX1 1/20 0.32
MAOA P21397 1/20 0.31

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
SCHEMBL18697229 0.91 KMT2A (0.34) HPGDMEN1KMT2ATNKSELANE
SCHEMBL10124693 0.88 ALDH1A1 (0.39) ALDH1A1CYP1A2CYP2C9CYP2C19CACNA1B
SCHEMBL13050168 0.86 ALDH1A1 (0.35) ALDH1A1CYP1A2CYP2C9CYP2C19CACNA1B
SCHEMBL10124692 0.84 ALDH1A1 (0.36) ALDH1A1CYP1A2CYP2C9CYP2C19CACNA1B
SCHEMBL10124695 0.82 ELANE (0.33) ALDH1A1CYP1A2CYP2C9CYP2C19CACNA1B
SCHEMBL10124696 0.81 MT-CO2 (0.33) ALDH1A1CYP1A2CYP2C9CYP2C19CACNA1B
SCHEMBL18697264 0.80 ELANE (0.35) ALDH1A1CYP1A2CYP2C9CYP2C19CACNA1B
SCHEMBL10124697 0.79 GRM2 (0.35) ALDH1A1CYP2C9CYP2C19HPGDLMNA
SCHEMBL18697263 0.72 POLB (0.40) ALDH1A1CACNA1BAPBA1LMNAPGR
SCHEMBL10124704 0.71 TRIP13 (0.33) ALDH1A1CACNA1BAPBA1

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
EP-2440557-B1 NOVEL STERICALLY HINDERED AMINE LIGHT STABILIZERS BASF SE (DE) 2017-04-05 EP disclosed