SCHEMBL11220132

SCHEMBL11220132

O=C(NC1=NCCS1)NC1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.53
USP2 O75604 1/20 0.53
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
HPGD P15428 2/20 0.52
POLB P06746 1/20 0.52
ALOX12 P18054 1/20 0.52
APOBEC3A P31941 1/20 0.52
APOBEC3G Q9HC16 1/20 0.52
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
TP53 P04637 1/20 0.50
EPHX1 P07099 7/20 0.48
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
EPHX2 P34913 2/20 0.48
CYP3A4 P08684 1/20 0.48
TSHR P16473 2/20 0.48
HTT P42858 1/20 0.47

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
SCHEMBL14364027 0.72 HPGD (0.63) SMN1; SMN2USP2MEN1KMT2AHPGD
SCHEMBL27554600 0.70
1,3-Dicyclohexylurea SCHEMBL2755 0.69 EPHX1 (1.00) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL12196125 0.69 EPHX1 (1.00) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL12196126 0.69 EPHX1 (1.00) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL23960132 0.69 EPHX1 (1.00) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL12196101 0.69 EPHX1 (1.00) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL24308701 0.69 EPHX1 (1.00) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL24308699 0.69 EPHX1 (1.00) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL15093798 0.69 EPHX1 (1.00) SMN1; SMN2MEN1KMT2ANPC1RAB9A

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
JP-57059880-A None JP disclosed
JP-S5759880-A UREA DERIVATIVE AND LIPOMETABOLISM IMPROVING AGENT CONTAINING THE SAME KYOWA HAKKO KOGYO CO LTD 1982-04-10 JP disclosed