SCHEMBL880676

SCHEMBL880676

CC(Cc1ccccc1)NC(=O)c1ccccc1

nearest known ligand 0.79

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.79
NPC1 O15118 4/20 0.79
SMN1; SMN2 Q16637 2/20 0.71
TP53 P04637 1/20 0.71
HPGD P15428 1/20 0.71
KMT2A Q03164 4/20 0.66
MEN1 O00255 3/20 0.66
HTT P42858 1/20 0.66
ACACB O00763 1/20 0.63
CTRB1 P17538 5/20 0.61
LMNA P02545 1/20 0.61
ALDH1A1 P00352 1/20 0.61
TAAR1 Q96RJ0 1/20 0.59
SIGMAR1 Q99720 1/20 0.58
HSP90AA1 P07900 1/20 0.57

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
SCHEMBL11949543 1.00 RAB9A (0.79) RAB9ANPC1SMN1; SMN2TP53HPGD
SCHEMBL24862899 0.90 RAB9A (0.67) RAB9ANPC1SMN1; SMN2TP53HPGD
SCHEMBL4103656 0.89 RAB9A (0.74) RAB9ANPC1SMN1; SMN2TP53HPGD
SCHEMBL23099741 0.89 NPC1 (0.74) RAB9ANPC1SMN1; SMN2TP53HPGD
SCHEMBL507202 0.88 RAB9A (0.76) RAB9ANPC1SMN1; SMN2TP53HPGD
SCHEMBL17914162 0.86 ATM (0.66) RAB9ANPC1SMN1; SMN2TP53HPGD
SCHEMBL17914156 0.86 RAB9A (0.62) RAB9ANPC1SMN1; SMN2TP53HPGD
SCHEMBL25890576 0.86 ACACB (0.67) RAB9ANPC1SMN1; SMN2TP53HPGD
SCHEMBL23099898 0.85 NPC1 (0.60) RAB9ANPC1SMN1; SMN2TP53HPGD
SCHEMBL3078645 0.85 LMNA (0.76) RAB9ANPC1SMN1; SMN2TP53HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114751920-B Antitumor compounds 法马马有限公司 2024-06-07 CN disclosed
CN-114736219-B Antitumor compounds 法马马有限公司 2024-06-07 CN disclosed
CN-117865987-A Antitumor compounds 法马马有限公司 2024-04-12 CN disclosed
CN-117580841-A Macrocyclic compounds and uses thereof 特修斯制药公司 2024-02-20 CN disclosed
CN-112384517-B Heteroaryl compounds and uses thereof 新旭生技股份有限公司 2023-07-14 CN disclosed
EP-3102193-B1 ANTIBACTERIAL AGENTS: N(ALPHA)-AROYL-N-ARYL-PHENYLALANINAMIDES UNIV RUTGERS (US) 2023-01-11 EP disclosed
CN-114736219-A Antitumor compounds 法马马有限公司 2022-07-12 CN disclosed
CN-108546643-B Process for large scale enzymatic synthesis of oligosaccharides 台湾地区“中央研究院” 2022-02-25 CN disclosed
CN-108611384-B Process for large scale enzymatic synthesis of oligosaccharides 台湾地区“中央研究院” 2022-02-25 CN disclosed
CN-108504703-B Process for large scale enzymatic synthesis of oligosaccharides 中央研究院 2021-06-29 CN disclosed
US-20090156682-A1 N-(1-Methyl-2Phenylethyl)Benzamide Derivatives BAYER INTELLECTUAL PROPERTY GMBH (DE) 2009-06-18 US disclosed
US-20080207757-A1 Polar Hydrophilic Prodrugs of Amphetamine and Other Stimulants and Processes for Making and Using the Same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-08-28 US disclosed
US-20080207757-A1 Polar Hydrophilic Prodrugs of Amphetamine and Other Stimulants and Processes for Making and Using the Same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-08-28 US disclosed
WO-2008098151-A2 POLAR HYDROPHILIC PRODRUGS OF AMPHETAMINE AND OTHER STIMULANTS AND PROCESSES FOR MAKING AND USING THE SAME KEMPHARM, INC. (US) 2008-08-14 WO disclosed
EP-1799684-A2 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-06-27 EP disclosed
EP-1146037-B1 PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE AMINO ALCOHOLS NIPPON SODA CO (JP) 2006-06-21 EP disclosed
WO-2006041773-A2 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2006-04-20 WO disclosed
EP-1440052-B1 BENZAMIDE DERIVATIVES AS ANTAGONISTS OF OREXIN RECEPTORS SMITHKLINE BEECHAM PLC (GB) 2005-12-14 EP disclosed
US-6410749-B1 REACTING A CARBONYL COMPOUND WITH ORGANOMETALLIC COMPOUND NIPPON SODA CO., LTD. (JP) 2002-06-25 US disclosed
EP-1146037-A1 PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE AMINO ALCOHOLS NIPPON SODA CO., LTD. (JP) 2001-10-17 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090156682-A1 N-(1-Methyl-2Phenylethyl)Benzamide Derivatives CYP51A1, CYP1A2, CYP1A1 RAB9A 1825/4885NPC1 175/4885SMN1; SMN2 1807/4885
US-20080207757-A1 Polar Hydrophilic Prodrugs of Amphetamine and Other Stimulants and Processes for Making and Using the Same SLC6A2, SLC6A3, SLC18A2 RAB9A 2253/4885NPC1 1495/4885SMN1; SMN2 2740/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.