SCHEMBL29637718

SCHEMBL29637718

CCCCNC(=O)CCCCCCCCCCCCCC(N)=O

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.65
CASP2 P42575 1/20 0.62
DNM1 Q05193 2/20 0.61
NAAA Q02083 1/20 0.58
SLC6A5 Q9Y345 2/20 0.57
EPHX2 P34913 3/20 0.54
CNR1 P21554 1/20 0.53
NOD1 Q9Y239 1/20 0.51
MEN1 O00255 1/20 0.50
MAPK1 P28482 1/20 0.50
KMT2A Q03164 1/20 0.50
SELP P16109 1/20 0.50

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
SCHEMBL4391096 1.00 FAAH (0.65) FAAHCASP2DNM1NAAASLC6A5
SCHEMBL29637700 1.00 FAAH (0.65) FAAHCASP2DNM1NAAASLC6A5
SCHEMBL10065860 1.00 FAAH (0.65) FAAHCASP2DNM1NAAASLC6A5
SCHEMBL14023079 1.00 FAAH (0.65) FAAHCASP2DNM1NAAASLC6A5
SCHEMBL6684491 0.98 FAAH (0.61) FAAHCASP2DNM1NAAASLC6A5
Acetic Acid SCHEMBL29046257 0.94 FAAH (0.59) FAAHCASP2DNM1NAAASLC6A5
SCHEMBL24102296 0.94 CASP2 (0.71) FAAHCASP2DNM1NAAASLC6A5
SCHEMBL21664563 0.94 CASP2 (0.71) FAAHCASP2DNM1NAAASLC6A5
SCHEMBL8680945 0.94 CASP2 (0.71) FAAHCASP2DNM1NAAASLC6A5
SCHEMBL21587881 0.94 FAAH (0.68) FAAHCASP2DNM1NAAASLC6A5

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-2022089408-A1 TETRAHYDRONAPHTHALENE COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF 广州市恒诺康医药科技有限公司 2022-05-05 WO disclosed