SCHEMBL27862268

SCHEMBL27862268

O=CN(S)c1cnccn1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ NAPRT Q6XQN6 1/20 0.33
▸ HCAR2 Q8TDS4 1/20 0.33
▸ ADORA3 P0DMS8 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MC4R P32245 1/20 0.32
▸ ADRA1A P35348 1/20 0.32
▸ MC3R P41968 1/20 0.32

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
SCHEMBL6592179 0.75 POLB (0.47) POLBKDM4EHSP90AA1NAPRTHCAR2
SCHEMBL27788485 0.75 POLB (0.39) POLBKDM4EHSP90AA1NAPRTHCAR2
SCHEMBL27322913 0.72 POLB (0.41) POLBKDM4EHSP90AA1NAPRTHCAR2
SCHEMBL27529146 0.72 POLB (0.44) POLBKDM4EHSP90AA1NAPRTHCAR2
SCHEMBL27515999 0.71 CYP2D6 (0.40) POLBKDM4ENAPRTTSHRADRA1A
SCHEMBL28687108 0.71 POLB (0.40) POLBKDM4EHSP90AA1NAPRTHCAR2
SCHEMBL1521276 0.69 POLB (0.48) POLBKDM4EHSP90AA1NAPRTHCAR2
SCHEMBL1889093 0.68 ADORA3 (0.47) POLBKDM4EHSP90AA1NAPRTHCAR2
SCHEMBL28860220 0.66 TRIM24 (0.32) KDM4EHSP90AA1
Ampyzine SCHEMBL30627403 0.66 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110352256-A The technique for leaching metal sulfide with the reagent with thiocarbonyl functionality 不列颠哥伦比亚大学 2019-10-18 — — CN disclosed
CN-107532229-A Process for leaching metal sulphides with an agent having a thiocarbonyl function 不列颠哥伦比亚大学 2018-01-02 — — CN disclosed
CN-107519168-A A kind of application of NRF2 inhibitor and its related compound treatment tuberculosis infection 中国医科大学 2017-12-29 — — CN disclosed
CN-102574788-A Indole derivatives as crac modulators HOFFMANN LA ROCHE 2012-07-11 — — CN disclosed
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