SCHEMBL94394

SCHEMBL94394

Oc1c(S)ccc2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN22 Q9Y2R2 1/20 0.60
HSD17B10 Q99714 2/20 0.50
ALDH1A1 P00352 1/20 0.50
CYP2A6 P11509 1/20 0.50
TSHR P16473 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
LDHA P00338 1/20 0.50
CYP1A2 P05177 2/20 0.46
HPRT1 P00492 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
HPGD P15428 1/20 0.46
CYP2C19 P33261 1/20 0.46
HIF1A Q16665 1/20 0.46
POLB P06746 1/20 0.45
USP2 O75604 1/20 0.43
PAK1 Q13153 1/20 0.43

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
SCHEMBL31094047 1.00 PTPN22 (0.60) PTPN22HSD17B10ALDH1A1CYP2A6TSHR
Alcohol SCHEMBL28874068 0.90 PTPN22 (0.50) PTPN22HSD17B10LDHACYP1A2CYP2C9
Dimethyl Sulfoxide SCHEMBL28242227 0.88 PTPN22 (0.48) PTPN22HSD17B10ALDH1A1CYP2A6TSHR
SCHEMBL17796881 0.80 ALDH1A1 (0.43) PTPN22HSD17B10ALDH1A1TDP1CYP1A2
SCHEMBL374807 0.75 PTPN22 (0.65) PTPN22HSD17B10ALDH1A1CYP2A6TSHR
SCHEMBL561071 0.75 ALDH1A1 (0.55) PTPN22HSD17B10ALDH1A1CYP2A6TSHR
SCHEMBL29613822 0.75 PTPN22 (1.00) PTPN22HSD17B10ALDH1A1CYP2A6TSHR
Hydrochloric Acid SCHEMBL28347175 0.75 PTPN22 (1.00) PTPN22HSD17B10ALDH1A1CYP2A6TSHR
SCHEMBL29401627 0.75 PTPN22 (0.65) PTPN22HSD17B10ALDH1A1CYP2A6TSHR
SCHEMBL28483 0.75 PTPN22 (1.00) PTPN22HSD17B10ALDH1A1CYP2A6TSHR

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 1136 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118603958-A Raman analysis method for ALS, APOC3, C3 and FCN2 proteins and biological application 上海市第四人民医院 2024-09-06 CN claimed
CN-107778360-B Method for preparing caspofungin acetate 鲁南制药集团股份有限公司 2020-06-12 CN claimed
CN-110452143-A A method of mildly efficiently synthesizing 1,3- disulfide derivative UNIV SOUTHWEST NATIONALITIES 2019-11-15 CN claimed
CN-108409617-B A kind of synthetic method of sulfide compound 湘潭大学 2019-09-27 CN claimed
CN-110172231-A A kind of refrigerant PBT resin composition and preparation method thereof 南通开普乐工程塑料有限公司 2019-08-27 CN claimed
CN-107064103-B A kind of silver of containing the internal standard molecule/gold nano cavity dendrite and its preparation method and application 安徽中科赛飞尔科技有限公司 2019-06-25 CN claimed
CN-107189317-B A kind of silver/polymer/silver/graphene core-shell nano mushroom material and its preparation method and application 宁波大学 2019-06-18 CN claimed
CN-106519945-B A kind of insulated paint and preparation method thereof 苏州太湖电工新材料股份有限公司 2019-05-24 CN claimed
CN-106807952-B A kind of synthesis Au25The method and Au of nanosphere25Nanosphere 中国科学院大连化学物理研究所 2019-05-07 CN claimed
CN-107643400-B The preparation method and applications of cancer markers detection architecture based on silver-colored aggregation-polymer and Crystal structure 宁波大学 2019-05-03 CN claimed
CN-1729044-A Melt spun polysulfone semipermeable membranes and methods of making the same BAXTER INT (US) 2006-02-01 CN claimed
US-20050178996-A1 Solvent-based fluorinated water and oil repellent and process for producing the same JINTEX CORPORATION LTD. (TW) 2005-08-18 US claimed
CN-1539821-A Molecule material of teera aryl aether pentacites 复旦大学 2004-10-27 CN claimed
CN-1149250-C Melt-spun polysulfone semipermeable membranes and methods for making the same ���Ͽع����޹�˾ 2004-05-12 CN claimed
EP-0658924-B1 Method of manufacturing electron-emitting device, electron source and image-forming apparatus CANON KK (JP) 2000-07-12 EP claimed
CN-1242025-A Melt spun polysulfone semipermeable membranes and methods of making the same ALTHIN MEDICAL INC (US) 2000-01-19 CN claimed
US-5622634-A Method of manufacturing electron-emitting device, electron source and image-forming apparatus CANON KABUSHIKI KAISHA (JP) 1997-04-22 US claimed
EP-0658924-A1 Method of manufacturing electron-emitting device, electron source and image-forming apparatus CANON KABUSHIKI KAISHA (JP) 1995-06-21 EP claimed
EP-0261079-B1 REACTIVE DYES, THEIR PREPARATION AND THEIR USE CIBA-GEIGY AG (CH) 1991-10-16 EP claimed
US-4070236-A Paper manufacture with improved retention agents SANDOZ LTD. (CH) 1978-01-24 US claimed