SCHEMBL10857640

SCHEMBL10857640

NCCSCc1ccc(CNCCO)o1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PRMT6 Q96LA8 1/20 0.51
▸ ACHE P22303 13/20 0.40
▸ BCHE P06276 9/20 0.40
▸ CHRM2 P08172 1/20 0.34
▸ HRH2 P25021 1/20 0.34
▸ PDCD1 Q15116 1/20 0.33
▸ CD274 Q9NZQ7 1/20 0.33

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
SCHEMBL11360362 0.85 PRMT6 (0.55) PRMT6ACHEBCHECHRM2HRH2
SCHEMBL11371642 0.81 PRMT6 (0.62) PRMT6ACHEBCHEHRH2
SCHEMBL10742212 0.80 CYP1A2 (0.49) PRMT6ACHEBCHEHRH2
SCHEMBL11214116 0.79 PRMT6 (0.62) PRMT6ACHEBCHE
SCHEMBL11463439 0.78 PRMT6 (0.50) PRMT6ACHEBCHEHRH2
SCHEMBL11209167 0.78 PRMT6 (0.50) PRMT6ACHEBCHEHRH2
SCHEMBL10846891 0.78 PRMT6 (0.50) PRMT6ACHEBCHEHRH2
SCHEMBL10741444 0.78 PRMT6 (0.61) PRMT6ACHEBCHEHRH2CD274
SCHEMBL10847872 0.77 PRMT6 (0.47) PRMT6ACHEBCHE
Hydrochloric Acid SCHEMBL11475500 0.77 PRMT6 (0.49) PRMT6ACHEBCHEHRH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4571398-A Cytosine derivatives having histamine H2 -antagonist activity SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1986-02-18 — — US disclosed
US-4567176-A HISTAMINE H2-ANTAGONISTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1986-01-28 — — US disclosed
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