SCHEMBL2115058

SCHEMBL2115058

Cc1cccc(-c2[c]cccc2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.42
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HPGD P15428 2/20 0.42
TSHR P16473 1/20 0.42
ALDH1A1 P00352 3/20 0.38
MAPT P10636 2/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
ENPP3 O14638 1/20 0.38
NOTUM Q6P988 1/20 0.38
IDO1 P14902 1/20 0.37
METAP2 P50579 1/20 0.37
PTPN5 P54829 1/20 0.37
TP53 P04637 2/20 0.36
NISCH Q9Y2I1 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36

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
SCHEMBL28000910 0.94 RAB9A (0.39) ACHERAB9ANPC1SMN1; SMN2HPGD
SCHEMBL6705304 0.83 ACHE (0.35) ACHETSHRALDH1A1MAPT
SCHEMBL5779452 0.82 ACHE (0.44) ACHERAB9ANPC1SMN1; SMN2HPGD
SCHEMBL183516 0.80 ALDH1A1 (0.35) RAB9AALDH1A1MEN1KMT2A
SCHEMBL589437 0.79 MAOA (0.41) ALDH1A1NISCHMEN1KMT2A
SCHEMBL26567 0.79 MAOA (0.41) ALDH1A1NISCHMEN1KMT2A
SCHEMBL67548 0.77 ACHE (0.38) ACHERAB9ANPC1SMN1; SMN2HPGD
SCHEMBL1141083 0.76 NPC1 (0.39) ACHERAB9ANPC1SMN1; SMN2TSHR
SCHEMBL2115007 0.76 NPC1 (0.42) RAB9ANPC1SMN1; SMN2TSHRNFKB1
SCHEMBL3298109 0.76 MAOA (0.54) RAB9ANPC1SMN1; SMN2HPGDALDH1A1

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 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115385956-A Biaryl diphosphine ligands and transition metal complexes thereof 东莞市均成高新材料有限公司 2022-11-25 CN claimed
US-7053056-B2 C-terminal modified oxamyl dipeptides as inhibitors of the ICE/ced-3 family of cysteine proteases IDUN PHARMACEUTICALS, INC. (US) 2006-05-30 US claimed
US-6544951-B2 Antiinflammatory agents; autoimmune diseases, nervous system degradation IDUN PHARMACEUTICALS, INC. 2003-04-08 US claimed
CN-117044428-A Lateral current suppressing material, carbazole compound, hole injection layer, and organic electroluminescent element 东曹株式会社 2023-11-10 CN disclosed
CN-115385956-A Biaryl diphosphine ligands and transition metal complexes thereof 东莞市均成高新材料有限公司 2022-11-25 CN disclosed
EP-2825574-B1 PROCESS FOR PRODUCING POLYDIENES BRIDGESTONE CORP (JP) 2016-02-24 EP disclosed
EP-2825574-A1 PROCESS FOR PRODUCING POLYDIENES Bridgestone Corporation (JP) 2015-01-21 EP disclosed
WO-2013138270-A1 PROCESS FOR PRODUCING POLYDIENES BRIDGESTSONE CORPORATION (JP) 2013-09-19 WO disclosed
EP-2570418-A2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-20 EP disclosed
EP-1555267-B1 2,3-DIHYDRO-6-NITROIMIDAZO[2,1-b]OXAZOLES OTSUKA PHARMA CO LTD (JP) 2013-01-16 EP disclosed
US-8158641-B2 2-anilino-4-aminoalkyleneaminopyrimidines BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-04-17 US disclosed
US-6147100-A ANTIINFLAMMATORY AGENTS SHIONOGI & CO., LTD. (JP) 2000-11-14 US disclosed
EP-0976748-A1 PYRROLIDINE DERIVATIVES HAVING PHOSPHOLIPASE A2 INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2000-02-02 EP disclosed
WO-1999037607-A1 POTASSIUM CHANNEL INHIBITORS ICAGEN, INC. (US) 1999-07-29 WO disclosed
EP-0857007-A1 ORGANIC ELECTROLUMINESCENT DEVICE TDK Corporation (JP) 1998-08-05 EP disclosed
US-4524168-A AZO DYES CIBA-GEIGY CORPORATION (US) 1985-06-18 US disclosed
EP-0006284-B1 RACEMIZING OF OPTICALLY ACTIVE ALPHA-SUBSTITUTED-ALPHA-PHENYLACETIC ACIDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-04-08 EP disclosed
US-4179511-A Antibacterial 3-(5-tetrazolyl) penam compounds PFIZER INC. (US) 1979-12-18 US disclosed
US-4143039-A ANTIBACTERIAL 3-(5-TETRAZOLYL)PENAM COMPOUNDS PFIZER INC. (US) 1979-03-06 US disclosed
US-4115385-A PENICILLINS PFIZER INC. (US) 1978-09-19 US disclosed