SCHEMBL4868656

SCHEMBL4868656

CN(CCN)Cc1ccnc2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.57
CARM1 Q86X55 9/20 0.49
PRMT6 Q96LA8 2/20 0.49
PRMT8 Q9NR22 2/20 0.49
FERMT2 Q96AC1 1/20 0.45
PRMT3 O60678 1/20 0.43
NCF1 P14598 1/20 0.43
PRMT1 Q99873 7/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 1/20 0.42
CYP2D6 P10635 2/20 0.41
CYP3A4 P08684 1/20 0.41
HIF1A Q16665 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
HRH3 Q9Y5N1 1/20 0.40
MAOA P21397 1/20 0.40

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
SCHEMBL10243025 0.83 LOXL2 (0.47) LOXL2LMNAGAAMEN1ALDH1A1
SCHEMBL12853829 0.82 LOXL2 (0.53) LOXL2NCF1LMNAGAAMEN1
SCHEMBL12855037 0.80 LOXL2 (0.58) LOXL2NCF1LMNAMEN1ALDH1A1
SCHEMBL4871016 0.76 MAOB (0.58) MAOB
SCHEMBL6223283 0.74 LOXL2 (0.71) LOXL2FERMT2NCF1LMNAALDH1A1
SCHEMBL263790 0.74 LOXL2 (1.00) LOXL2FERMT2NCF1LMNAALDH1A1
Hydrochloric Acid SCHEMBL20592932 0.73 LOXL2 (0.69) LOXL2FERMT2NCF1LMNAALDH1A1
Hydrochloric Acid SCHEMBL3643761 0.72 LOXL2 (0.96) LOXL2FERMT2NCF1LMNAALDH1A1
Hydrochloric Acid SCHEMBL1208908 0.72 LOXL2 (0.96) LOXL2FERMT2NCF1LMNAALDH1A1
SCHEMBL336172 0.71 LOXL2 (0.67) LOXL2FERMT2NCF1LMNAALDH1A1

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
US-7332476-B2 Pyridyl substituted ketolide antibiotics NOVARTIS AG (CH) 2008-02-19 US disclosed
US-7332476-B2 Pyridyl substituted ketolide antibiotics NOVARTIS AG (CH) 2008-02-19 US disclosed
US-7332476-B2 Pyridyl substituted ketolide antibiotics NOVARTIS AG (CH) 2008-02-19 US disclosed
US-20050009764-A1 Pyridyl substituted ketolide antibiotics CHIRON CORPORATION (US) 2005-01-13 US disclosed
US-6756359-B2 ADMINISTERING A 14 MEMBERED MACROLIDE AND KETOLIDE ANTIBIOTICS CONTAINING C12 MODIFICATIONS TO A PATIENT SUFFERING FROM BACTERIAL INFECTIONS CHIRON CORPORATION 2004-06-29 US disclosed
US-20030125266-A1 C12 Modified erythromycin macrolides and ketolides having antibacterial activity CHU DANIEL (US) 2003-07-03 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 (2 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-20050009764-A1 Pyridyl substituted ketolide antibiotics PKLR, KHK, PGD LOXL2 1023/4885CARM1 4874/4885PRMT6 4040/4885
US-20030125266-A1 C12 Modified erythromycin macrolides and ketolides having antibacterial activity MRPL21, CYP51A1, CEL LOXL2 2701/4885CARM1 4584/4885PRMT6 3551/4885

“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.