SCHEMBL22355532

SCHEMBL22355532

CC(C)OC(=O)CNP(=O)(OCC1CCC(c2ccc3c(N)ncnn23)O1)Oc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ BTN3A1 O00481 2/20 0.34
▸ RIPK1 Q13546 4/20 0.34
▸ CYP3A4 P08684 2/20 0.34
▸ CYP2C9 P11712 2/20 0.34
▸ DOT1L Q8TEK3 1/20 0.34
▸ POLRMT O00411 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
SCHEMBL22393430 0.89 CYP3A4 (0.44) BTN3A1RIPK1CYP3A4CYP2C9DOT1L
SCHEMBL22393558 0.89 CYP3A4 (0.44) BTN3A1RIPK1CYP3A4CYP2C9DOT1L
SCHEMBL24058411 0.89 DOT1L (0.32) RIPK1DOT1LPOLRMT
SCHEMBL22355507 0.89 DOT1L (0.32) RIPK1DOT1LPOLRMT
SCHEMBL18666884 0.89 DOT1L (0.32) RIPK1DOT1LPOLRMT
SCHEMBL19504133 0.89 DOT1L (0.32) RIPK1DOT1LPOLRMT
SCHEMBL24699947 0.88 BTN3A1 (0.34) BTN3A1RIPK1CYP3A4CYP2C9DOT1L
SCHEMBL24700006 0.88 BTN3A1 (0.34) BTN3A1RIPK1CYP3A4CYP2C9DOT1L
SCHEMBL23047652 0.87 RIPK1 (0.33) BTN3A1RIPK1CYP3A4CYP2C9DOT1L
SCHEMBL24158211 0.87 DOT1L (0.34) RIPK1DOT1LPOLRMT

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 3 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-3785717-A1 METHODS FOR TREATING CORONAVIRIDAE INFECTIONS Gilead Sciences, Inc. (US) 2021-03-03 — — EP disclosed
EP-3695844-A1 METHODS FOR TREATING NIPAH VIRUS INFECTIONS Gilead Sciences, Inc. (US) 2020-08-19 — — EP disclosed
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