SCHEMBL6796809

SCHEMBL6796809

Brc1ccc(-c2nnco2)nc1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 1/20 0.42
▸ NOTUM Q6P988 15/20 0.42
▸ TSHR P16473 1/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ MAPK1 P28482 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
SCHEMBL30297889 0.78 NOTUM (0.56) NOTUMTSHRNPC1RAB9AALDH1A1
SCHEMBL2644943 0.78 NOTUM (0.42) NOTUMNPC1RAB9AALDH1A1HPGD
SCHEMBL21241342 0.78 NOTUM (0.56) NOTUMTSHRNPC1RAB9AALDH1A1
SCHEMBL24921604 0.74 NOTUM (0.50) NOTUMTSHRNPC1RAB9AALDH1A1
SCHEMBL30050215 0.74 NPSR1 (0.52) NOTUMHPGD
SCHEMBL26096222 0.73 NOTUM (0.44) NOTUMTSHRNPC1RAB9AALDH1A1
SCHEMBL1194538 0.72 NOTUM (0.64) NOTUMTSHRNPC1RAB9AALDH1A1
SCHEMBL40864 0.72 KDM4E (0.46) CA2TSHRNPC1RAB9AALDH1A1
SCHEMBL29843360 0.72 CA2 (0.40) CA2ALDH1A1
SCHEMBL1558150 0.72 CA2 (0.40) CA2ALDH1A1

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-6689779-B2 PYRIDINE OR PYRIMIDINE SUBSTITUTED; ANTIBACTERIAL ACTIVITY; LOW TOXICITY DONG A PHARM. CO., LTD. (KR) 2004-02-10 — — US disclosed
US-20030166620-A1 Novel oxazolidinone derivatives and a process for the preparation thereof DONG A PHARM. CO., LTD. (KR) 2003-09-04 — — 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-20030166620-A1 Novel oxazolidinone derivatives and a process for the preparation thereof OXA1L, ODC1, PDCD4 CA2 3914/4885NOTUM 3221/4885TSHR 3527/4885

“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