SCHEMBL4393073

SCHEMBL4393073

CCOC(=O)c1cn(Cc2ccc(OC)cc2OC)c2nc(N3CCC3CO)ccc2c1=O

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 7/20 0.44
ALDH1A1 P00352 4/20 0.44
POLB P06746 3/20 0.44
TDP1 Q9NUW8 1/20 0.44
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
TP53 P04637 2/20 0.41
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ATM Q13315 1/20 0.39

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
SCHEMBL4393074 1.00 GNRHR (0.44) GNRHRALDH1A1POLBTDP1TSHR
SCHEMBL4401025 0.95 TSHR (0.44) GNRHRALDH1A1POLBTDP1TSHR
SCHEMBL4397300 0.95 TSHR (0.44) GNRHRALDH1A1POLBTDP1TSHR
SCHEMBL4397302 0.95 TSHR (0.44) GNRHRALDH1A1POLBTDP1TSHR
SCHEMBL4404009 0.95 GNRHR (0.42) GNRHRALDH1A1POLBTDP1TSHR
SCHEMBL4400078 0.91 ALDH1A1 (0.41) ALDH1A1POLBTDP1TSHRKDM4E
SCHEMBL4400068 0.91 ALDH1A1 (0.41) ALDH1A1POLBTDP1TSHRKDM4E
SCHEMBL4401298 0.86 KMT2A (0.41) ALDH1A1POLBTDP1TSHRMAPK1
SCHEMBL4405985 0.86 KMT2A (0.41) ALDH1A1POLBTDP1TSHRMAPK1
SCHEMBL4401291 0.86 KMT2A (0.41) ALDH1A1POLBTDP1TSHRMAPK1

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-7632946-B2 Naphthyridine-based antibacterial compositions ABBOTT LABORATORIES (US) 2009-12-15 US disclosed
US-20070088040-A1 Antibacterial compounds ABBVIE INC. 2007-04-19 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-20070088040-A1 Antibacterial compounds MRPL21, FDPS, PGLS GNRHR 4592/4885ALDH1A1 2936/4885POLB 520/4885

“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.