SCHEMBL7964249

SCHEMBL7964249

c1nc(-c2cscn2)cs1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
ALDH1A1 P00352 1/20 0.50
KDM4A O75164 2/20 0.47
KDM4B O94953 2/20 0.47
KDM5C P41229 2/20 0.47
KDM5B Q9UGL1 2/20 0.47
METAP1 P53582 7/20 0.42
METAP2 P50579 6/20 0.42
KDM4E B2RXH2 2/20 0.42
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
RAB9A P51151 1/20 0.42
FKBP1A P62942 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HIF1A Q16665 1/20 0.42

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
SCHEMBL1743331 0.78 KDM4E (0.61) TSHRALDH1A1KDM4AKDM4BKDM5C
SCHEMBL3610416 0.78 HDAC8 (0.39) TSHRALDH1A1KDM4AKDM4BKDM5C
SCHEMBL3854174 0.76 KDM4A (0.42) TSHRALDH1A1KDM4AKDM4BKDM5C
SCHEMBL679287 0.76 KDM4E (0.52) ALDH1A1KDM4ENPC1TP53CYP1A2
SCHEMBL17701231 0.75 KDM4A (0.34) TSHRALDH1A1KDM4AKDM4BKDM5C
SCHEMBL3145603 0.75 KDM4A (0.38) TSHRALDH1A1KDM4AKDM4BKDM5C
SCHEMBL16720504 0.75 KDM4A (0.41) TSHRALDH1A1KDM4AKDM4BKDM5C
SCHEMBL17701248 0.75 KDM4A (0.34) TSHRALDH1A1KDM4AKDM4BKDM5C
SCHEMBL6512842 0.74 RAB9A (0.47) TSHRALDH1A1KDM4AKDM4BKDM5C
SCHEMBL16720341 0.74 KDM4A (0.37) TSHRALDH1A1KDM4AKDM4BKDM5C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115867534-A Non-lysosomal glucosylceramidase inhibitors and uses thereof 阿勒克图治疗公司 2023-03-28 CN claimed
CN-115803025-A Non-lysosomal glucosylceramidase inhibitors and uses thereof 阿勒克图治疗公司 2023-03-14 CN claimed
CN-115867534-A Non-lysosomal glucosylceramidase inhibitors and uses thereof 阿勒克图治疗公司 2023-03-28 CN disclosed
CN-115803025-A Non-lysosomal glucosylceramidase inhibitors and uses thereof 阿勒克图治疗公司 2023-03-14 CN disclosed
CN-113045590-B Perylene diimide non-fullerene acceptor material and application thereof 四川大学 2022-03-08 CN disclosed
CN-113045590-B Perylene diimide non-fullerene acceptor material and application thereof 四川大学 2022-03-08 CN disclosed
CN-109134454-B Preparation method and application of bithiazole azo compound 山西大同大学 2021-08-27 CN disclosed
CN-113045590-A Perylene diimide non-fullerene acceptor material and application thereof 四川大学 2021-06-29 CN disclosed
CN-113045590-A Perylene diimide non-fullerene acceptor material and application thereof 四川大学 2021-06-29 CN disclosed
US-9562167-B2 Magnetic recording medium and magnetic coating composition for magnetic recording medium FUJIFILM CORPORATION (JP) 2017-02-07 US disclosed
US-9562167-B2 Magnetic recording medium and magnetic coating composition for magnetic recording medium FUJIFILM CORPORATION (JP) 2017-02-07 US disclosed
US-20150279403-A1 MAGNETIC RECORDING MEDIUM AND MAGNETIC COATING COMPOSITION FOR MAGNETIC RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2015-10-01 US disclosed
US-20150279403-A1 MAGNETIC RECORDING MEDIUM AND MAGNETIC COATING COMPOSITION FOR MAGNETIC RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2015-10-01 US disclosed
US-6187928-B1 TREATING FUNGAL DISEASES THE ROCKEFELLER UNIVERSITY 2001-02-13 US disclosed
US-6087510-A Method of use of imidazolium cations THE ROCKEFELLER UNIVERSITY (US) 2000-07-11 US disclosed
US-5969150-A FLUORESCENT COMPOUNDS FOR MEDICAL DIAGNOSIS, DRUGS AND LABELS OR FUNGICIDES AND VIRICIDES THE ROCKEFELLER UNIVERSITY (US) 1999-10-19 US disclosed
US-5874587-A FLUORESCENCE THE ROCKEFELLER UNIVERSITY (US) 1999-02-23 US disclosed