SCHEMBL9205871

SCHEMBL9205871

Cc1noc(C(=O)N2CCCCC2)c1OC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.40
KMT2A Q03164 4/20 0.40
MEN1 O00255 2/20 0.40
NPC1 O15118 5/20 0.39
RAB9A P51151 4/20 0.39
HTT P42858 2/20 0.39
TSHR P16473 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 6/20 0.38
RECQL P46063 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
POLB P06746 1/20 0.38
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
LPAR5 Q9H1C0 1/20 0.36

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
SCHEMBL9206968 0.86 HPGD (0.40) HPGDKMT2AMEN1NPC1RAB9A
SCHEMBL9198152 0.82 HPGD (0.37) HPGDKMT2AMEN1NPC1RAB9A
SCHEMBL9205868 0.79 KMT2A (0.46) HPGDKMT2AMEN1NPC1RAB9A
SCHEMBL9592251 0.74 CYP1A2 (0.43) HPGDKMT2AMEN1NPC1RAB9A
SCHEMBL9199703 0.73 POLB (0.37) KMT2AMEN1NPC1RAB9AHTT
SCHEMBL9526741 0.72 LMNA (0.43) HPGDKMT2AMEN1HTTL3MBTL1
SCHEMBL13214815 0.69 LIPE (0.51) HPGDKMT2AMEN1NPC1RAB9A
SCHEMBL3417324 0.69 GAA (0.37) KMT2AMEN1HTTTSHRL3MBTL1
SCHEMBL9591673 0.69 CYP1A2 (0.41) HPGDKMT2AMEN1NPC1RAB9A
SCHEMBL9526216 0.68 ALDH1A1 (0.37) NPC1RAB9AHTTL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0418667-B1 Carboxylic acid amides BASF AG (DE) 1995-08-16 EP disclosed
EP-0418667-A2 Carboxylic acid amides BASF Aktiengesellschaft (DE) 1991-03-27 EP disclosed