SCHEMBL9488239

SCHEMBL9488239

OCCn1nnnc1-c1nnnn1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
POLB P06746 4/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPT P10636 2/20 0.46
LMNA P02545 3/20 0.45
HTT P42858 3/20 0.45
HSD17B10 Q99714 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
TSHR P16473 2/20 0.44
HPGD P15428 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
HSD11B1 P28845 2/20 0.43
CYP1A2 P05177 3/20 0.43
CYP2C19 P33261 2/20 0.43
PKM P14618 2/20 0.43
NPC1 O15118 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43

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
SCHEMBL11536760 0.81 ALDH1A1 (0.65) ALDH1A1L3MBTL1POLBMEN1KMT2A
SCHEMBL10635287 0.80 ALDH1A1 (0.68) ALDH1A1POLBMEN1KMT2AHTT
SCHEMBL890039 0.72 LMNA (0.77) ALDH1A1L3MBTL1MEN1KMT2AMAPT
SCHEMBL15541266 0.71 ALDH1A1 (0.63) ALDH1A1L3MBTL1MEN1KMT2AMAPT
Bromide SCHEMBL351809 0.71 LMNA (0.74) ALDH1A1L3MBTL1MEN1KMT2AMAPT
Bromide SCHEMBL28098177 0.71 LMNA (0.74) ALDH1A1L3MBTL1MEN1KMT2AMAPT
Hydrochloric Acid SCHEMBL7981337 0.71 LMNA (0.74) ALDH1A1L3MBTL1MEN1KMT2AMAPT
SCHEMBL2968359 0.70 HSD11B1 (0.61) ALDH1A1L3MBTL1POLBMEN1KMT2A
SCHEMBL10635294 0.70 ALDH1A1 (0.62) ALDH1A1POLBMEN1KMT2AHTT
SCHEMBL97010 0.69 HTT (0.60) ALDH1A1L3MBTL1POLBMEN1KMT2A

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-0548338-A1 PROCESS FOR THE PREPARATION OF CEPHALOSPORINS INTERMEDIATES. ANTIBIOTICOS SPA (IT) 1993-06-30 EP claimed
WO-1993002085-A1 PROCESS FOR THE PREPARATION OF CEPHALOSPORINS INTERMEDIATES ANTIBIOTICOS S.P.A. (IT) 1993-02-04 WO claimed