SCHEMBL398169

SCHEMBL398169

Nc1ccccc1SC(F)(F)F

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
NPSR1 Q6W5P4 2/20 0.54
APOBEC3G Q9HC16 1/20 0.54
CYP3A4 P08684 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
POLB P06746 1/20 0.43
ALDH1A1 P00352 5/20 0.43
TDP1 Q9NUW8 2/20 0.43
KDM4E B2RXH2 1/20 0.43
SMN1; SMN2 Q16637 4/20 0.41
ALOX15 P16050 2/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
LMNA P02545 3/20 0.39
TSHR P16473 2/20 0.39
HTT P42858 2/20 0.39

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
SCHEMBL2197151 1.00 MAPT (0.54) MAPTMEN1KMT2ANPSR1APOBEC3G
SCHEMBL29549836 1.00 MAPT (0.54) MAPTMEN1KMT2ANPSR1APOBEC3G
SCHEMBL7006953 0.82 MAPT (0.50) MAPTMEN1KMT2ANPSR1APOBEC3G
SCHEMBL2054201 0.79 AHR (0.38) MAPTMEN1KMT2ANPSR1APOBEC3G
SCHEMBL6863388 0.76 KMT2A (0.54) MAPTMEN1KMT2ANPSR1APOBEC3G
SCHEMBL3096171 0.76 KMT2A (0.43) MAPTMEN1KMT2ANPSR1APOBEC3G
SCHEMBL16657271 0.74 MEN1 (0.52) MAPTMEN1KMT2ANPSR1APOBEC3G
SCHEMBL31171603 0.73 HTR7 (0.39) ALDH1A1TDP1KDM4ELMNAHTT
SCHEMBL525897 0.73 ALDH1A1 (0.42) MAPTALDH1A1TDP1KDM4ELMNA
SCHEMBL3831544 0.73 HTR7 (0.39) ALDH1A1TDP1KDM4ELMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10991972-B2 Electrolyte solution, positive electrode, and lithium-ion battery comprising the electrolyte solution and/or the positive electrode BYD COMPANY LIMITED (CN) 2021-04-27 US claimed
US-20190036156-A1 ELECTROLYTE SOLUTION, POSITIVE ELECTRODE, AND LITHIUM-ION BATTERY COMPRISING THE ELECTROLYTE SOLUTION AND/OR THE POSITIVE ELECTRODE BYD COMPANY LIMITED (CN) 2019-01-31 US claimed
EP-3407416-A1 ELECTROLYTIC SOLUTION, POSITIVE ELECTRODE, AND LITHIUM-ION BATTERY CONTAINING THE ELECTROLYTIC SOLUTION AND/OR THE POSITIVE ELECTRODE BYD Company Limited (CN) 2018-11-28 EP claimed
CN-116023321-B STING inhibitor prodrug and medical application thereof 中国药科大学 2024-11-29 CN disclosed
WO-2024141128-A4 STING INHIBITOR PRODRUG AND MEDICAL USE THEREOF 中国药科大学 2024-09-19 WO disclosed
WO-2024141128-A2 STING INHIBITOR PRODRUG AND MEDICAL USE THEREOF 中国药科大学 2024-07-04 WO disclosed
WO-2024121183-A1 NEW CYANOPYRIDINE KHK INHIBITOR COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2024-06-13 WO disclosed
CN-116023321-A STING inhibitor prodrug and medical application thereof 中国药科大学 2023-04-28 CN disclosed
US-10991972-B2 Electrolyte solution, positive electrode, and lithium-ion battery comprising the electrolyte solution and/or the positive electrode BYD COMPANY LIMITED (CN) 2021-04-27 US disclosed
US-10991972-B2 Electrolyte solution, positive electrode, and lithium-ion battery comprising the electrolyte solution and/or the positive electrode BYD COMPANY LIMITED (CN) 2021-04-27 US disclosed
EP-3705477-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS Vertex Pharmaceuticals Incorporated (US) 2020-09-09 EP disclosed
US-4581059-A PREEMERGENCE, POSTEMERGENCE HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-04-08 US disclosed
EP-0113956-A1 Herbicidal phenoxy esters of N-((heterocyclic)aminocarbonyl) sulfamic acid E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-07-25 EP disclosed
US-4459304-A MITICIDES, NEMATOCIDES, FUNGICIDES, BACTERICIDES, INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1984-07-10 US disclosed
US-4317824-A ANTISEPTICS, ANIMAL GROWTH PROMOTORS ABIC, LTD. (IL) 1982-03-02 US disclosed
EP-0000156-B1 2-ARYLAMINO-3,5-DINITRO-BENZOTRIFLUORIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PESTICIDES. BAYER AG (DE) 1980-11-12 EP disclosed
US-4161540-A SUBSTITUTED ANILIDE SCHERING CORPORATION (US) 1979-07-17 US disclosed
US-4144270-A NITRO OR HALOGEN SUBSTITUTED CARBOCYCLIC AMIDES SCHERING CORPORATION (US) 1979-03-13 US disclosed
US-4139638-A NITRO OR HALOGEN SUBSTITUTED ANILIDES, ANTIANDROGENS, ACNE, CANCER SCHERING CORPORATION (US) 1979-02-13 US disclosed
US-3995060-A SUBSTITUTED ANILIDES SCHERING CORPORATION (US) 1976-11-30 US disclosed