SCHEMBL9716936

SCHEMBL9716936

CCCCCCCCCCCCOC(C(N)=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MMP9 P14780 1/20 0.49
MMP8 P22894 1/20 0.49
MMP13 P45452 1/20 0.49
LMNA P02545 4/20 0.49
CYP3A4 P08684 2/20 0.49
MEN1 O00255 1/20 0.49
NR1I2 O75469 1/20 0.49
CHRM2 P08172 1/20 0.49
ADRA2A P08913 1/20 0.49
MAPT P10636 1/20 0.49
OPRK1 P41145 1/20 0.49
HTR2B P41595 1/20 0.49
SLC6A3 Q01959 1/20 0.49
KMT2A Q03164 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
TSHR P16473 3/20 0.46
ALDH1A1 P00352 2/20 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
SCHEMBL10698580 0.98 LMNA (0.48) NPC1RAB9ASMN1; SMN2MMP9MMP8
SCHEMBL5508979 0.88 SMN1; SMN2 (0.51) NPC1RAB9ASMN1; SMN2LMNACYP3A4
SCHEMBL8081132 0.88 SMN1; SMN2 (0.51) NPC1RAB9ASMN1; SMN2LMNACYP3A4
SCHEMBL8072241 0.88 SMN1; SMN2 (0.51) NPC1RAB9ASMN1; SMN2LMNACYP3A4
SCHEMBL8081523 0.88 SMN1; SMN2 (0.51) NPC1RAB9ASMN1; SMN2LMNACYP3A4
SCHEMBL10639062 0.88 SMN1; SMN2 (0.51) NPC1RAB9ASMN1; SMN2LMNACYP3A4
SCHEMBL8081509 0.88 SMN1; SMN2 (0.51) NPC1RAB9ASMN1; SMN2LMNACYP3A4
SCHEMBL20538944 0.87 LMNA (0.43) SMN1; SMN2LMNACYP3A4MEN1CHRM2
SCHEMBL2406969 0.86 SMN1; SMN2 (0.50) NPC1RAB9ASMN1; SMN2LMNACYP3A4
SCHEMBL9999772 0.84 ALDH1A1 (0.53) NPC1RAB9ASMN1; SMN2LMNACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992009561-A1 NEW AMIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-06-11 WO disclosed