SCHEMBL11544924

SCHEMBL11544924

O=C(O)c1cccc(OCC(O)CNc2ccc(Cl)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 4/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
TAAR1 Q96RJ0 1/20 0.56
MAPT P10636 3/20 0.55
HTT P42858 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
NR4A1 P22736 1/20 0.50
NR4A3 Q92570 1/20 0.50
NR1H4 Q96RI1 1/20 0.49
ADRB1 P08588 1/20 0.48
ADRB3 P13945 1/20 0.48
PPARA Q07869 1/20 0.47
MRGPRX4 Q96LA9 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL11549983 0.88 PPARA (0.61) MEN1KMT2ATAAR1MAPTHTT
SCHEMBL11544838 0.85 MAPT (0.61) NR4A2KMT2AMAPTHTTSMN1; SMN2
SCHEMBL11548347 0.85 MAPT (0.61) NR4A2MEN1KMT2AMAPTHTT
SCHEMBL11546865 0.85 MAPT (0.61) NR4A2MEN1KMT2AMAPTHTT
SCHEMBL11545859 0.85 NR4A2 (0.64) NR4A2MEN1KMT2ATAAR1NR4A1
SCHEMBL11548488 0.81 SMN1; SMN2 (0.52) MEN1KMT2ATAAR1MAPTHTT
SCHEMBL9741522 0.80 NR4A2 (0.61) NR4A2KMT2ANR4A1NR4A3NR1H4
SCHEMBL10950575 0.79 KMT2A (0.53) MEN1KMT2ATAAR1MAPTHTT
SCHEMBL11545229 0.79 NR4A2 (0.56) NR4A2MEN1KMT2ATAAR1NR4A1
SCHEMBL11450956 0.78 MAPT (0.85) MEN1KMT2AMAPTHTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4144351-A ANTICHOLESTEROL KLINGE PHARMA GMBH & CO. (DE) 1979-03-13 US disclosed
US-4109013-A SUBSTITUTED PROPANOL-(2) DERIVATIVES OF HYDROXAMIC ACIDS AND THE USE THEREOF AS HYPOLIPEMIC DRUGS KLINGE PHARMA GMBH & CO. (DE) 1978-08-22 US disclosed
US-4073935-A Substituted propanol-(2)-derivatives and their nicotinic acid esters, and process for their preparation, and the use thereof as hypolipemic drugs KLINGE PHARMA GMBH & CO. (DT) 1978-02-14 US disclosed