SCHEMBL823767

SCHEMBL823767

CC(C)Oc1nc(N)nc2ccc(-c3ccc(C(=O)NC4CCCCC4)cc3)nc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.53
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
HPGD P15428 2/20 0.53
MKNK1 Q9BUB5 2/20 0.46
MKNK2 Q9HBH9 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MAP4K4 O95819 1/20 0.44
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
ACVR2A P27037 1/20 0.41
TGFBR2 P37173 1/20 0.41
LCK P06239 1/20 0.41
KIT P10721 1/20 0.41
KDR P35968 1/20 0.41
MAPK9 P45984 1/20 0.41
MAPK14 Q16539 1/20 0.41
AURKA O14965 1/20 0.40
AURKB Q96GD4 1/20 0.40

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
SCHEMBL823721 0.99 SMN1; SMN2 (0.51) SMN1; SMN2NPC1RAB9AHPGDMKNK1
SCHEMBL823813 0.95 MKNK1 (0.45) SMN1; SMN2NPC1RAB9AHPGDMKNK1
SCHEMBL825712 0.87 MKNK1 (0.46) SMN1; SMN2NPC1RAB9AHPGDMKNK1
SCHEMBL823683 0.86 MKNK2 (0.46) MKNK1MKNK2MAP4K4HDAC4ROCK2
SCHEMBL823680 0.86 MKNK1 (0.49) SMN1; SMN2NPC1RAB9AHPGDMKNK1
SCHEMBL825655 0.86 MKNK1 (0.47) SMN1; SMN2NPC1RAB9AHPGDMKNK1
SCHEMBL823731 0.84 MKNK1 (0.47) SMN1; SMN2NPC1RAB9AHPGDMKNK1
SCHEMBL3332812 0.84 SMN1; SMN2 (0.54) SMN1; SMN2NPC1RAB9AHPGDNPSR1
SCHEMBL826265 0.84 MKNK1 (0.44) SMN1; SMN2NPC1RAB9AHPGDMKNK1
SCHEMBL823724 0.83 MKNK2 (0.38) MKNK1MKNK2MAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090324543-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC (US) 2009-12-31 US claimed
US-8143394-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2012-03-27 US disclosed
US-8143394-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2012-03-27 US disclosed
US-8143394-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2012-03-27 US disclosed
US-20090324543-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC (US) 2009-12-31 US disclosed
US-20090324543-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC (US) 2009-12-31 US disclosed
US-20090324543-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC (US) 2009-12-31 US disclosed
WO-2008077649-A1 PYRIDO(3,2-D)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTONS GILEAD SCIENCES, INC. (US) 2008-07-03 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090324543-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS PNPO, DPYD, PLPBP SMN1; SMN2 1295/4885NPC1 3135/4885RAB9A 3030/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.