SCHEMBL4276979

SCHEMBL4276979

c1ccc(-c2ccccc2-c2nnco2)cc1

nearest known ligand 0.70

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 14/20 0.70
TLR8 Q9NR97 1/20 0.51
KMT2A Q03164 1/20 0.50
NPC1 O15118 1/20 0.47
TP53 P04637 1/20 0.47
TSHR P16473 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
GPR55 Q9Y2T6 1/20 0.47

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
SCHEMBL3283250 0.96 NOTUM (0.66) NOTUMTLR8KMT2ANPC1TP53
SCHEMBL27854127 0.85 NOTUM (0.54) NOTUMTLR8KMT2ANPC1TP53
SCHEMBL9641641 0.85 NOTUM (0.66) NOTUMTLR8KMT2ANPC1TP53
SCHEMBL9555 0.83 NOTUM (1.00) NOTUMTLR8NPC1TSHRRAB9A
Biphenyl SCHEMBL22577775 0.81 NOTUM (0.95) NOTUMTLR8NPC1TSHRRAB9A
SCHEMBL5571187 0.79 NOTUM (0.91) NOTUMTLR8TSHR
SCHEMBL6190865 0.78 NOTUM (0.59) NOTUMTLR8KMT2ANPC1TP53
SCHEMBL4162448 0.78 NOTUM (0.51) NOTUMTLR8NPC1TP53TSHR
SCHEMBL12479205 0.76 NOTUM (0.61) NOTUMTLR8KMT2ANPC1TP53
SCHEMBL7050954 0.76 NOTUM (1.00) NOTUMTLR8KMT2ANPC1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111613730-B Organic light emitting device and electronic apparatus 三星显示有限公司 2024-04-19 CN disclosed
CN-111613730-A Organic light emitting device and electronic apparatus 三星显示有限公司 2020-09-01 CN disclosed
US-20090105251-A1 Renin inhibitors TAKEDA SAN DIEGO, INC. 2009-04-23 US disclosed
US-20090105251-A1 Renin inhibitors TAKEDA SAN DIEGO, INC. 2009-04-23 US disclosed
US-20090105251-A1 Renin inhibitors TAKEDA SAN DIEGO, INC. 2009-04-23 US disclosed
US-6884994-B2 High temperature scintillator SCHLUMBERGER TECHNOLOGY CORPORATION (US) 2005-04-26 US 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-20090105251-A1 Renin inhibitors REN, ACE, AGT NOTUM 561/4885TLR8 4682/4885KMT2A 4735/4885

“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.