SCHEMBL19344220

SCHEMBL19344220

Nc1ncnn2c([C@H]3CCC(CO)O3)ccc12

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CYP2A6 P11509 3/20 0.39
▸ ACVRL1 P37023 3/20 0.36
▸ DOT1L Q8TEK3 3/20 0.35
▸ POLRMT O00411 1/20 0.34
▸ MAP4K4 O95819 1/20 0.33
▸ PIK3CD O00329 2/20 0.31
▸ TNK2 Q07912 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ STING1 Q86WV6 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ ALB P02768 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ TNIK Q9UKE5 1/20 0.30

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
SCHEMBL19343962 1.00 CYP2A6 (0.39) CYP2A6ACVRL1DOT1LPOLRMTMAP4K4
SCHEMBL18667150 1.00 CYP2A6 (0.39) CYP2A6ACVRL1DOT1LPOLRMTMAP4K4
SCHEMBL4970560 1.00 CYP2A6 (0.39) CYP2A6ACVRL1DOT1LPOLRMTMAP4K4
SCHEMBL20834955 0.90 DOT1L (0.35) CYP2A6ACVRL1DOT1LPOLRMTMAP4K4
SCHEMBL19344234 0.88 CYP2A6 (0.39) CYP2A6ACVRL1DOT1LPOLRMTMAP4K4
SCHEMBL24058306 0.86 POLRMT (0.35) DOT1LPOLRMTMAP4K4STING1TNIK
SCHEMBL23959828 0.83 CYP2A6 (0.38) CYP2A6
SCHEMBL24606310 0.82 DOT1L (0.36) DOT1LPOLRMTPIK3CD
SCHEMBL24340458 0.82 POLRMT (0.43) DOT1LPOLRMT
SCHEMBL22355531 0.82 POLRMT (0.43) DOT1LPOLRMT

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
EP-3212175-B1 METHODS FOR THE PREPARATION OF RIBOSIDES GILEAD SCIENCES INC (US) 2021-11-24 — — EP disclosed
EP-3426664-B1 SUBSTITUTED NUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2021-06-30 — — EP disclosed
EP-3785717-A1 METHODS FOR TREATING CORONAVIRIDAE INFECTIONS Gilead Sciences, Inc. (US) 2021-03-03 — — EP disclosed
WO-2017153186-A1 SUBSTITUTED NUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2017-09-14 — — WO disclosed
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