SCHEMBL8938028

SCHEMBL8938028

CCc1c(-c2ccc(-c3ccccc3)cc2)[c]ccc1-c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP7 Q93009 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MAPT P10636 2/20 0.33
DHODH Q02127 1/20 0.33
GCGR P47871 1/20 0.33
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA7 P36544 1/20 0.32
CHRNA4 P43681 1/20 0.32
HPGD P15428 2/20 0.32
TAAR1 Q96RJ0 2/20 0.32
ALDH1A1 P00352 2/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
MGLL Q99685 1/20 0.31
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30
TP53 P04637 1/20 0.30

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
SCHEMBL983062 0.79 SMN1; SMN2 (0.33) SMN1; SMN2L3MBTL1MAPTGCGRHPGD
SCHEMBL11121321 0.77 USP7 (0.39) USP7SMN1; SMN2DHODHGCGRHPGD
SCHEMBL9559655 0.75 KMT2A (0.32) SMN1; SMN2MAPTHPGD
SCHEMBL9559699 0.71 HPGD (0.44) SMN1; SMN2MAPTCHRNB2CHRNB4CHRNA3
SCHEMBL9806251 0.71 PDCD1 (0.47) USP7SMN1; SMN2GCGRHPGDALDH1A1
SCHEMBL891578 0.70 LMNA (0.36) MAPTHPGDALDH1A1
SCHEMBL4621655 0.70 ALDH1A1 (0.39) SMN1; SMN2L3MBTL1MAPTHPGDTAAR1
SCHEMBL9559675 0.69 HPGD (0.46) SMN1; SMN2MAPTCHRNB2CHRNB4CHRNA3
SCHEMBL9559710 0.69 HPGD (0.46) SMN1; SMN2MAPTCHRNB2CHRNB4CHRNA3
SCHEMBL984059 0.69 KDM4E (0.37) SMN1; SMN2MAPTHPGDALDH1A1

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
US-5508273-A ARALKYLPHOSPHONATES FOR OSTEOPOROSIS ORTHO PHARMACEUTICAL CORPORATION (US) 1996-04-16 US disclosed