SCHEMBL10848949

SCHEMBL10848949

NCCSCc1ccc(CNCc2ccco2)o1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRMT6 Q96LA8 1/20 0.49
▸ KMT2A Q03164 3/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ CHRM2 P08172 1/20 0.43
▸ POLB P06746 4/20 0.42
▸ ALDH1A1 P00352 5/20 0.42
▸ MAPT P10636 2/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ PTPN7 P35236 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ ATM Q13315 1/20 0.38
▸ GAA P10253 2/20 0.37
▸ CA12 O43570 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA4 P22748 1/20 0.36
▸ BCHE P06276 1/20 0.36

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
SCHEMBL10846891 0.81 PRMT6 (0.50) PRMT6KMT2AMEN1ALDH1A1TDP1
SCHEMBL705421 0.81 ALDH1A1 (0.53) PRMT6KMT2AMEN1POLBALDH1A1
Hydrochloric Acid SCHEMBL11475500 0.80 PRMT6 (0.49) PRMT6KMT2AMEN1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL10746854 0.80 ALDH1A1 (0.51) PRMT6KMT2APOLBALDH1A1MAPT
SCHEMBL10851079 0.78 POLB (0.47) PRMT6KMT2AMEN1POLBALDH1A1
SCHEMBL10857640 0.77 PRMT6 (0.51) PRMT6CHRM2BCHEACHE
SCHEMBL11360362 0.77 PRMT6 (0.55) PRMT6CHRM2BCHEACHE
SCHEMBL11463439 0.75 PRMT6 (0.50) PRMT6BCHEACHE
SCHEMBL11209167 0.75 PRMT6 (0.50) PRMT6BCHEACHE
SCHEMBL10741444 0.75 PRMT6 (0.61) PRMT6BCHEACHE

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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