SCHEMBL7984841

SCHEMBL7984841

CCNc1nc2ccc(N)cc2s1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.56
GAA P10253 5/20 0.52
KEAP1 Q14145 1/20 0.51
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
GFER P55789 1/20 0.49
MAPT P10636 7/20 0.49
KDM4E B2RXH2 4/20 0.49
GLA P06280 3/20 0.49
RIPK1 Q13546 1/20 0.48
ALDH1A1 P00352 4/20 0.47
LMNA P02545 2/20 0.47
ALOX12 P18054 1/20 0.47
HTT P42858 1/20 0.47
ABL1 P00519 1/20 0.46
PKM P14618 2/20 0.46
HPGD P15428 2/20 0.46
CA1 P00915 1/20 0.46

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
SCHEMBL18384865 0.88 RIPK1 (0.55) SMN1; SMN2GAAKEAP1NPC1RAB9A
SCHEMBL8019525 0.82 NPC1 (0.59) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL30123733 0.81 SMN1; SMN2 (0.61) SMN1; SMN2GAAKEAP1NPC1RAB9A
SCHEMBL21588479 0.81 SMN1; SMN2 (0.50) SMN1; SMN2GAAKEAP1NPC1RAB9A
SCHEMBL12297548 0.81 SMN1; SMN2 (0.59) SMN1; SMN2GAAKEAP1NPC1RAB9A
SCHEMBL13994543 0.81 SMN1; SMN2 (0.49) SMN1; SMN2GAAKEAP1NPC1RAB9A
SCHEMBL3748870 0.81 SMN1; SMN2 (0.49) SMN1; SMN2GAAKEAP1NPC1RAB9A
SCHEMBL4500811 0.81 NPC1 (0.50) SMN1; SMN2GAANPC1RAB9AMEN1
SCHEMBL19141067 0.81 DYRK1A (0.46) SMN1; SMN2GAANPC1RAB9AMEN1
SCHEMBL27864412 0.81 MAPT (0.64) SMN1; SMN2GAANPC1RAB9AMEN1

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-20170253607-A1 LONG-ACTING HIV PROTEASE INHIBITOR SHIONOGI & CO., LTD. (JP) 2017-09-07 US disclosed
WO-2001074771-A1 PYRROLE-2,5-DIONE DERIVATIVES FOR THE TREATMENT OF DIABETES SMITHKLINE BEECHAM P.L.C. (GB) 2001-10-11 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-20170253607-A1 LONG-ACTING HIV PROTEASE INHIBITOR CPN1, HAT1, PRSS1 SMN1; SMN2 3538/4885GAA 1507/4885KEAP1 4173/4885

“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.