SCHEMBL23830303

SCHEMBL23830303

CCOC(=O)Cc1ncc(C)cc1N

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.50
DPP4 P27487 3/20 0.47
HSP90AA1 P07900 1/20 0.40
CHEK1 O14757 1/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPK1 P28482 3/20 0.38
RECQL P46063 1/20 0.38
POLB P06746 1/20 0.38
TSHR P16473 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
HSD17B10 Q99714 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL16050342 0.85 SMN1; SMN2 (0.48) SMN1; SMN2DPP4HSP90AA1CHEK1ALDH1A1
SCHEMBL17548192 0.85 SMN1; SMN2 (0.48) SMN1; SMN2DPP4HSP90AA1CHEK1ALDH1A1
SCHEMBL17436079 0.85 SMN1; SMN2 (0.48) SMN1; SMN2DPP4HSP90AA1CHEK1ALDH1A1
SCHEMBL10515631 0.80 DPP4 (0.43) SMN1; SMN2DPP4ALDH1A1MAPK1RECQL
SCHEMBL10513315 0.80 HSP90AA1 (0.46) SMN1; SMN2DPP4HSP90AA1ALDH1A1MAPK1
SCHEMBL6643658 0.77 SMN1; SMN2 (0.49) SMN1; SMN2DPP4HSP90AA1ALDH1A1MAPK1
SCHEMBL31347161 0.75 MAPT (0.52) SMN1; SMN2DPP4CHEK1ALDH1A1MAPK1
SCHEMBL5791166 0.75 MAPT (0.52) SMN1; SMN2DPP4CHEK1ALDH1A1MAPK1
SCHEMBL13622778 0.74 ALDH1A1 (0.44) HSP90AA1ALDH1A1MAPK1HSD17B10KDM4E
SCHEMBL17887300 0.74 NOS3 (0.45) SMN1; SMN2HSP90AA1ALDH1A1TSHRKDM4E

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-2970119-B1 NOVEL INDOLE DERIVATIVES USEFUL AS ANTI-DIABETIC AGENTS MERCK SHARP & DOHME (US) 2021-11-03 EP disclosed
US-20210292333-A1 CONDENSED AZAHETEROARYL COMPOUNDS HAVING ANTIBACTERIAL ACTIVITY AGAINST TUBERCULOSIS BACTERIA CADILA HEALTHCARE LIMITED (IN) 2021-09-23 US disclosed
CN-112543757-A Condensed azaheteroaryl compounds having antibacterial activity against tubercle bacillus 卡迪拉保健有限公司 2021-03-23 CN 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-20210292333-A1 CONDENSED AZAHETEROARYL COMPOUNDS HAVING ANTIBACTERIAL ACTIVITY AGAINST TUBERCULOSIS BACTERIA DPEP1, SAT1, PEPD SMN1; SMN2 4576/4885DPP4 35/4885HSP90AA1 1966/4885

“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.