SCHEMBL9877530

SCHEMBL9877530

CC(C)(C)NC(=O)N(O)Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.48
MAPT P10636 2/20 0.48
LMNA P02545 2/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
RIPK1 Q13546 1/20 0.48
MME P08473 2/20 0.47
ACE P12821 2/20 0.47
TAAR1 Q96RJ0 1/20 0.46
RAB9A P51151 1/20 0.44
ALOX5 P09917 4/20 0.44
MMP3 P08254 1/20 0.44
FFAR1 O14842 1/20 0.44
MMP12 P39900 2/20 0.43
SLC6A2 P23975 1/20 0.43
MMP13 P45452 1/20 0.43
PTGES O14684 1/20 0.42
ABCC4 O15439 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
SCHEMBL9876964 0.83 TAAR1 (0.50) NPC1LMNARIPK1MMEACE
SCHEMBL9878344 0.81 ALDH1A1 (0.58) NPC1LMNARAB9AABCC4GAA
SCHEMBL9707541 0.80 RIPK1 (0.59) LMNARIPK1MMEACETAAR1
SCHEMBL9707312 0.77 PTGS1 (0.62) MAPTLMNARIPK1TAAR1ALOX5
SCHEMBL26154407 0.75 RIPK1 (0.51) MAPTRIPK1MMEACETAAR1
SCHEMBL10870045 0.75 LTB4R2 (0.56) ALOX5TSHRHTT
SCHEMBL13575261 0.73 MEN1 (0.58) NPC1MAPTLMNARIPK1RAB9A
SCHEMBL25189833 0.72 RIPK1 (0.47) NPC1MAPTLMNARIPK1MME
SCHEMBL9877346 0.71 MEN1 (0.62) NPC1LMNARAB9APTGESTSHR
SCHEMBL25194677 0.70 RIPK1 (0.44) NPC1LMNARIPK1MMEACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5036157-A Hydroxamic acid derivatives, lipoxygenase and cyclooxygenase inhibitors, anticoagulants, antiinflammatory agents BURROUGHS WELLCOME CO. 1991-07-30 US disclosed
US-4977188-A Hydroamic acid derivatives BURROUGHS WELLCOME CO. (US) 1990-12-11 US disclosed
WO-1990001929-A1 NEW MEDICAL USE THE WELLCOME FOUNDATION LIMITED (GB) 1990-03-08 WO disclosed
US-4738986-A CYCLOOXYGENASE, LIDOXYGENASE INHIBITORS BURROUGHS WELLCOME CO. (US) 1988-04-19 US disclosed