SCHEMBL3026924

SCHEMBL3026924

COc1cnc2ccc(=O)nc-2[nH]1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SPR P35270 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ CBFB Q13951 4/20 0.36
▸ HIF1A Q16665 3/20 0.35
▸ TNKS O95271 2/20 0.34
▸ PARP1 P09874 1/20 0.34
▸ TNKS2 Q9H2K2 1/20 0.34
▸ RECQL P46063 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ALOX15 P16050 1/20 0.33

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
SCHEMBL7520950 0.65 — —
SCHEMBL18036013 0.65 CBFB (0.46) SPRSMN1; SMN2KDM4ELMNAPOLB
SCHEMBL18036027 0.63 CBFB (0.44) SPRKDM4EPOLBCBFBHIF1A
SCHEMBL31546321 0.60 ALDH1A1 (0.51) CBFBTNKSALDH1A1
SCHEMBL28539826 0.60 — —
SCHEMBL5887078 0.60 NPC1 (0.41) SMN1; SMN2KDM4EPOLBTNKSPARP1
SCHEMBL15893928 0.58 NUDT1 (0.32) LMNACYP3A4NPC1RAB9A
SCHEMBL1983843 0.56 MASP2 (0.39) SMN1; SMN2KDM4ETNKSPARP1TNKS2
SCHEMBL15993522 0.56 SCD (0.39) SMN1; SMN2ALDH1A1HPGDNPC1RAB9A
SCHEMBL15893923 0.55 TSHR (0.38) KDM4E

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
US-20100197679-A1 COMPOUNDS GLAXO GROUP LIMITED 2010-08-05 — — US disclosed
EP-2139898-A1 COMPOUNDS Glaxo Group Limited (GB) 2010-01-06 — — EP disclosed
WO-2008128961-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2008-10-30 — — 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-20100197679-A1 COMPOUNDS NRDC, MRPL21, NISCH SPR 1775/4885SMN1; SMN2 2526/4885KDM4E 4262/4885

“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.

Send feedback