SCHEMBL340620

SCHEMBL340620

COc1cc(C(C)=O)ccc1OCc1ccccc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.75
RAB9A P51151 2/20 0.75
SMN1; SMN2 Q16637 2/20 0.75
HPGD P15428 1/20 0.75
KDM4E B2RXH2 1/20 0.67
MEN1 O00255 1/20 0.67
KMT2A Q03164 1/20 0.67
SMPD1 P17405 2/20 0.65
HDAC1 Q13547 1/20 0.65
HDAC8 Q9BY41 1/20 0.65
HDAC6 Q9UBN7 1/20 0.65
MRGPRX4 Q96LA9 2/20 0.63
RXRA P19793 1/20 0.62
ATM Q13315 1/20 0.61
MAOB P27338 2/20 0.59
MTNR1A P48039 1/20 0.58
MTNR1B P49286 1/20 0.58
ABCB1 P08183 1/20 0.58
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56

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
SCHEMBL31025721 1.00 NPC1 (0.75) NPC1RAB9ASMN1; SMN2HPGDKDM4E
SCHEMBL9236564 0.94 SMPD1 (0.73) NPC1RAB9ASMN1; SMN2HPGDKDM4E
SCHEMBL3123036 0.92 MAOB (0.64) NPC1RAB9ASMN1; SMN2HPGDKDM4E
SCHEMBL4939800 0.90 NPC1 (0.62) NPC1RAB9ASMN1; SMN2HPGDKDM4E
SCHEMBL242563 0.90 MRGPRX4 (0.77) NPC1RAB9ASMN1; SMN2HPGDKDM4E
SCHEMBL27881765 0.90 NPC1 (0.77) NPC1RAB9ASMN1; SMN2HPGDKDM4E
SCHEMBL11277266 0.88 MRGPRX4 (0.75) NPC1RAB9ASMN1; SMN2HPGDKDM4E
SCHEMBL19225761 0.88 NPC1 (0.60) NPC1RAB9ASMN1; SMN2HPGDKDM4E
SCHEMBL6812967 0.87 NPC1 (0.59) NPC1RAB9ASMN1; SMN2HPGDKDM4E
SCHEMBL341137 0.87 NPC1 (0.73) NPC1RAB9ASMN1; SMN2HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119191945-A Synthetic method of (+/-) -guaifenesin-beta-O-4' -dihydroconiferyl alcohol 盈科瑞(天津)创新医药研究有限公司 2024-12-27 CN disclosed
CN-111253385-B Heterocyclic compound, preparation method and application 遵义医科大学珠海校区 2023-11-24 CN disclosed
CN-115433124-A Preparation method of 4-chloro-6-methoxy-7-benzyloxy quinoline 常州佳德医药科技有限公司 2022-12-06 CN disclosed
US-11447754-B2 In vitro methods of chemical conversion using non-stereospecific glutathione lyases WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2022-09-20 US disclosed
EP-2956138-B1 THERAPEUTIC COMPOUNDS AND USES THEREOF KALA PHARMACEUTICALS INC (US) 2022-06-22 EP disclosed
US-11358949-B2 Carbamate and urea compounds as multikinase inhibitors ANGEX PHARMACEUTICAL, INC. (US) 2022-06-14 US disclosed
EP-3329918-B1 C-MET MODULATORS AND METHODS OF USE EXELIXIS INC (US) 2022-05-25 EP disclosed
US-20220089600-A1 TGFß INHIBITOR AND PRODRUGS FUNDACIÓ INSTITUT DE RECERCA BIOMÈDICA (IRB BARCELONA) (ES) 2022-03-24 US disclosed
US-20220089600-A1 TGFß INHIBITOR AND PRODRUGS FUNDACIÓ INSTITUT DE RECERCA BIOMÈDICA (IRB BARCELONA) (ES) 2022-03-24 US disclosed
US-20210393641-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF OXFORD FINANCE LLC 2021-12-23 US disclosed
US-6005103-A TREATMENT OF BACTERIAL AND VIRAL INFECTIONS AND DISEASES, INCLUDING AIDS WARNER-LAMBERT COMPANY (US) 1999-12-21 US disclosed
EP-0888310-A1 CINNOLINE DERIVATIVES AND USE AS MEDICINE ZENECA LIMITED (GB) 1999-01-07 EP disclosed
US-5808062-A AIDS THERAPY WARNER-LAMBERT COMPANY (US) 1998-09-15 US disclosed
WO-1997034876-A1 CINNOLINE DERIVATIVES AND USE AS MEDICINE ZENECA LIMITED (GB) 1997-09-25 WO disclosed
CN-1155279-A Neuroprotective 3-(piperidinyl-1)-chroman-4,7,-diol and 1-(4-hydrophenyl)-2-(piperidinyl-1)-alkane alcohol PFIZER (US) 1997-07-23 CN disclosed
EP-0729466-A1 PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS PARKE, DAVIS & COMPANY (US) 1996-09-04 EP disclosed
EP-0729465-A1 PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS PARKE, DAVIS & COMPANY (US) 1996-09-04 EP disclosed
WO-1995014013-A1 PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS PARKE, DAVIS & COMPANY (US) 1995-05-26 WO disclosed
WO-1995014014-A2 PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS PARKE, DAVIS & COMPANY (US) 1995-05-26 WO disclosed
US-4098816-A HYPOGLYCEMIC AGENTS AND ANTILIPEMIC AGENTS BEECHAM GROUP LIMITED (GB) 1978-07-04 US 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 (3 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-20220089600-A1 TGFß INHIBITOR AND PRODRUGS TGFB1, TGFBR1, TGFBR2 NPC1 1441/4885RAB9A 2472/4885SMN1; SMN2 2893/4885
US-20210393641-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF MUC1, CFTR, SLC26A4 NPC1 10/4885RAB9A 546/4885SMN1; SMN2 2990/4885
US-11358949-B2 Carbamate and urea compounds as multikinase inhibitors UCK2, ULK2, CDK9 NPC1 1857/4885RAB9A 1236/4885SMN1; SMN2 4195/4885

“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.