SCHEMBL6796256

SCHEMBL6796256

O=C(CSc1ccccc1)Nc1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.78
HSD17B10 Q99714 3/20 0.78
HTT P42858 3/20 0.78
LMNA P02545 2/20 0.78
POLB P06746 2/20 0.71
KMT2A Q03164 4/20 0.69
RAB9A P51151 4/20 0.69
MEN1 O00255 3/20 0.69
TSHR P16473 2/20 0.68
PPARG P37231 1/20 0.68
NCOA2 Q15596 1/20 0.68
NCOA1 Q15788 1/20 0.68
NCOA3 Q9Y6Q9 1/20 0.68
L3MBTL1 Q9Y468 2/20 0.66
MAPK1 P28482 1/20 0.66
SMN1; SMN2 Q16637 1/20 0.66
CYP2C9 P11712 1/20 0.64
CYP2C19 P33261 1/20 0.64
MAPT P10636 3/20 0.63
NPY5R Q15761 1/20 0.61

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
Ammonia Solution, Strong SCHEMBL28437729 0.98 ALDH1A1 (0.76) ALDH1A1HSD17B10HTTLMNAPOLB
SCHEMBL2339823 0.90 KMT2A (0.74) ALDH1A1HSD17B10HTTLMNAPOLB
SCHEMBL14208824 0.88 NPC1 (0.69) ALDH1A1HSD17B10HTTLMNAPOLB
SCHEMBL28442353 0.88 ALDH1A1 (0.88) ALDH1A1HSD17B10HTTLMNAPOLB
SCHEMBL28437500 0.84 ALDH1A1 (0.58) ALDH1A1HSD17B10HTTLMNAPOLB
SCHEMBL10016622 0.84 RAB9A (0.64) ALDH1A1HSD17B10HTTLMNAPOLB
SCHEMBL11704645 0.84 POLB (0.70) ALDH1A1HSD17B10HTTLMNAPOLB
SCHEMBL11704653 0.84 POLB (0.62) ALDH1A1HSD17B10HTTLMNAPOLB
SCHEMBL11887807 0.83 HSD17B10 (0.61) ALDH1A1HSD17B10HTTLMNAPOLB
SCHEMBL9126255 0.82 L3MBTL1 (0.72) ALDH1A1HSD17B10LMNAPOLBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111499549-B Method for preparing fenbendazole intermediate 2-nitro-4-thiophenyl aniline 山东国邦药业有限公司 2022-04-22 CN claimed
US-9719183-B2 Non-cyanide gold plating bath and method for preparing non-cyanide gold plating bath KANTO GAKUIN SCHOOL CORPORATION (JP) 2017-08-01 US claimed
US-20150167191-A1 NON-CYANIDE GOLD PLATING BATH AND METHOD FOR PREPARING NON-CYANIDE GOLD PLATING BATH KANTO GAKUIN SCHOOL CORPORATION (JP) 2015-06-18 US claimed
JP-4234357-A None JP disclosed
CN-111499549-B Method for preparing fenbendazole intermediate 2-nitro-4-thiophenyl aniline 山东国邦药业有限公司 2022-04-22 CN disclosed
CN-111499549-B Method for preparing fenbendazole intermediate 2-nitro-4-thiophenyl aniline 山东国邦药业有限公司 2022-04-22 CN disclosed
US-9719183-B2 Non-cyanide gold plating bath and method for preparing non-cyanide gold plating bath KANTO GAKUIN SCHOOL CORPORATION (JP) 2017-08-01 US disclosed
US-20150167191-A1 NON-CYANIDE GOLD PLATING BATH AND METHOD FOR PREPARING NON-CYANIDE GOLD PLATING BATH KANTO GAKUIN SCHOOL CORPORATION (JP) 2015-06-18 US disclosed
US-7635181-B2 Ink for ink jet-recording curable through irradiation with a radioactive ray and method for preparing lithographic printing plates using the same FUJIFILM CORPORATION (JP) 2009-12-22 US disclosed
US-7635181-B2 Ink for ink jet-recording curable through irradiation with a radioactive ray and method for preparing lithographic printing plates using the same FUJIFILM CORPORATION (JP) 2009-12-22 US disclosed
US-6743794-B2 MULTIDRUG RESISTANCE PROTEIN; CANCER; 3-(9-CHLORO-3-METHYL-4-OXO-5H-ISOXAZOLO(4,3-C)QUINOLIN-5-YL)) CYCLOHEXYL)-2-PIPERIDYLACETAMIDE ELI LILLY AND COMPANY 2004-06-01 US disclosed
EP-0469888-B1 Amidobenzenes ICI PLC (GB) 1994-09-28 EP disclosed
US-5250570-A Aldose reductase inhibitors for controlling side effects of diabetes and galactosemia IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-10-05 US disclosed
JP-H04234357-A AMIDOBENZENES IMPERIAL CHEM IND PLC <ICI> 1992-08-24 JP disclosed
EP-0469888-A1 Amidobenzenes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-02-05 EP disclosed
US-3939184-A Production of carbonyl compounds substituted in α-position BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1976-02-17 US disclosed