SCHEMBL19908604

SCHEMBL19908604

Cc1cc(C(=O)CN2CCCCC2)cc(C)c1C

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 0.55
ALPG P10696 1/20 0.55
ALDH1A1 P00352 5/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
POLB P06746 2/20 0.54
GLA P06280 1/20 0.53
MAOB P27338 3/20 0.51
KDM4E B2RXH2 2/20 0.49
HPGD P15428 2/20 0.49
RECQL P46063 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
HTT P42858 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
RAD52 P43351 1/20 0.46
RAB9A P51151 1/20 0.45

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
SCHEMBL8053456 0.77 ALDH1A1 (0.67) ALPLALPGALDH1A1MEN1KMT2A
SCHEMBL19908712 0.77 ALPL (0.47) ALPLALPGALDH1A1MEN1KMT2A
SCHEMBL11807447 0.77 ALDH1A1 (0.56) ALPLALPGALDH1A1MEN1KMT2A
SCHEMBL4936082 0.76 MEN1 (0.75) ALPLALPGALDH1A1MEN1KMT2A
SCHEMBL23469137 0.76 ALPL (0.43) ALPLALPGALDH1A1MEN1KMT2A
SCHEMBL14311506 0.75 ALDH1A1 (0.64) ALPLALPGALDH1A1MEN1KMT2A
SCHEMBL3928222 0.74 ALDH1A1 (0.69) ALPLALPGALDH1A1KMT2AGLA
SCHEMBL11814029 0.74 ALPL (0.53) ALPLALPGALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL9851658 0.73 ALDH1A1 (0.70) ALPLALPGALDH1A1KMT2AGLA
Bromide SCHEMBL9787677 0.73 ALDH1A1 (0.69) ALPLALPGALDH1A1MEN1KMT2A

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-3287441-B1 ACYLATED 4-AMINOPIPERIDINES AS INHIBITORS OF SERINE PALMITOYLTRANSFERASE TAKEDA PHARMACEUTICALS CO (JP) 2021-06-09 EP disclosed
EP-3287441-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2018-02-28 EP disclosed