SCHEMBL7237456

SCHEMBL7237456

Cn1cc(C(=O)OCC[N+](C)(C)C)c(=O)c2cc3cc(F)c(N4CCN(c5ccc(F)cc5)CC4)cc3nc21

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 2/20 0.38
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 3/20 0.38
HPGD P15428 3/20 0.38
HSD17B10 Q99714 3/20 0.38
THRB P10828 3/20 0.37
HTR4 Q13639 1/20 0.37
TSHR P16473 1/20 0.35
CSF1R P07333 1/20 0.34
TP53 P04637 2/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL7228015 0.90 ALDH1A1 (0.47) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL7228137 0.87 ALDH1A1 (0.36) LMNAMEN1KMT2AMAPTALDH1A1
Choline SCHEMBL7237451 0.87 LMNA (0.40) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL6603300 0.85 LMNA (0.55) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL6603303 0.81 LMNA (0.44) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL7235505 0.81 KDM4E (0.46) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL9786124 0.80 ALDH1A1 (0.48) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL7235904 0.76 TP53 (0.34) MAPTALDH1A1TSHRTP53POLB
SCHEMBL7227506 0.76 LMNA (0.47) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL7227652 0.76 DRD3 (0.53) LMNAMEN1KMT2AALDH1A1KDM4E

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-6548506-B2 1-substituted,3-carboxy,7-fluoro,8-disubstituted amino-1,4-dihydrobenzo(b)(1,8)naphthyridin-4-ones; Useful as antimicrobial agents; topical antibiotic for wounds AVENTIS PHARMA S.A. (FR) 2003-04-15 US disclosed
US-20020037891-A1 Novel benzo[1,8]naphthyridine derivatives, their preparation and pharmaceutical compositions which comprise them AVENTIS PHARMA S.A. (FR) 2002-03-28 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-20020037891-A1 Novel benzo[1,8]naphthyridine derivatives, their preparation and pharmaceutical compositions which comprise them ABCB11, NDUFA9, NDUFC1 LMNA 1363/4885MEN1 2627/4885KMT2A 4345/4885

“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.