SCHEMBL11469239

SCHEMBL11469239

OCc1[nH]ccc1Cc1ccc(Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
RAB9A P51151 1/20 0.38
DAO P14920 2/20 0.37
RHEB Q15382 1/20 0.36
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
HIF1A Q16665 1/20 0.35
HSD17B10 Q99714 1/20 0.35
SLC5A1 P13866 1/20 0.35
SLC5A2 P31639 1/20 0.35
DBH P09172 1/20 0.34
MPO P05164 1/20 0.34
IDO1 P14902 1/20 0.33
NOTUM Q6P988 1/20 0.33

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
SCHEMBL11281110 0.82 HRH3 (0.39) IDO1
SCHEMBL11276656 0.82 ALDH1A1 (0.37) MAPTDAOSLC5A1SLC5A2IDO1
SCHEMBL11370488 0.82 MAPT (0.36) MAPTLMNADAOSLC5A1SLC5A2
SCHEMBL11362552 0.80 MAPT (0.43) MAPTDAORHEBDBHMPO
SCHEMBL11361264 0.78 LTA4H (0.44) MEN1KMT2ASLC5A1SLC5A2MPO
SCHEMBL1491971 0.74
SCHEMBL11362714 0.70 DAO (0.40) DAODBHMPOIDO1
SCHEMBL11632014 0.69 MEN1 (0.47) MAPTMEN1KMT2ANPC1LMNA
SCHEMBL8992959 0.69 IDO1 (0.46) MAPTMEN1KMT2ALMNAIDO1
SCHEMBL11685074 0.67 MEN1 (0.53) MAPTMEN1KMT2ALMNACYP3A4

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-4229352-A Benzylpyrrolylmethyl esters of cyclopropane carboxylic acids ZOECON CORPORATION (US) 1980-10-21 US disclosed