SCHEMBL9293120

SCHEMBL9293120

COc1ccc([C](CCCc2ccccc2)c2cccc3ccccc23)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
ALDH1A1 P00352 5/20 0.49
GCGR P47871 1/20 0.48
KMT2A Q03164 2/20 0.48
RECQL P46063 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MTNR1A P48039 2/20 0.47
MTNR1B P49286 1/20 0.47
ALOX5 P09917 1/20 0.45
PLAAT3 P53816 1/20 0.44
PLAAT5 Q96KN8 1/20 0.44
PLAAT2 Q9NWW9 1/20 0.44
PLAAT4 Q9UL19 1/20 0.44
CACNA1B Q00975 1/20 0.44
APBA1 Q02410 1/20 0.44
MAPT P10636 1/20 0.43
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALOX12 P18054 1/20 0.42

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
SCHEMBL27773350 0.79 CACNA1B (0.50) NPC1RAB9AALDH1A1GCGRKMT2A
SCHEMBL29250490 0.78 CACNA1B (0.46) RAB9AALDH1A1GCGRKMT2AMTNR1A
SCHEMBL931122 0.76 NPC1 (0.60) NPC1RAB9AALDH1A1KMT2ARECQL
SCHEMBL383491 0.74 RAB9A (0.51) NPC1RAB9AALDH1A1GCGRKMT2A
SCHEMBL5079813 0.74 GPR52 (0.48) NPC1RAB9AALDH1A1KMT2AMAPT
SCHEMBL6750240 0.73 RAB9A (0.54) NPC1RAB9AALDH1A1GCGRKMT2A
SCHEMBL1303471 0.73 NPC1 (0.85) NPC1RAB9AALDH1A1KMT2ARECQL
SCHEMBL10925556 0.72 NR4A1 (0.48) ALDH1A1KMT2AMAPTLMNAPTPN1
SCHEMBL7267678 0.71 GPR52 (0.48) NPC1RAB9AALDH1A1SMN1; SMN2PTPN1
SCHEMBL16549911 0.71 RAB9A (0.51) NPC1RAB9AALDH1A1GCGRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5359053-A Nucleic acid probes having nucleoside residue; usable with stringent hybridization conditions G. D. SEARLE & CO. (US) 1994-10-25 US disclosed
US-5134066-A Hybridization MONSANTO COMPANY (US) 1992-07-28 US disclosed
EP-0415901-A2 Improved nucleic acid probes MONSANTO COMPANY (US) 1991-03-06 EP disclosed