SCHEMBL14995335

SCHEMBL14995335

NCc1ccnc2ncccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 2/20 0.62
DPP4 P27487 1/20 0.40
KDM4E B2RXH2 3/20 0.38
MAPT P10636 3/20 0.38
LMNA P02545 4/20 0.38
AOC1 P19801 2/20 0.36
AOC3 Q16853 2/20 0.36
GPR84 Q9NQS5 1/20 0.36
ADRB2 P07550 1/20 0.35
HSP90AA1 P07900 3/20 0.35
NPC1 O15118 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
HSP90AB1 P08238 2/20 0.35
HTT P42858 2/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35
ALOX12 P18054 1/20 0.35
GAA P10253 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL15415316 0.81 KDM4E (0.53) LOXL2KDM4EMAPTLMNAGPR84
SCHEMBL3151202 0.79 LOXL2 (0.38) LOXL2KDM4EMAPTLMNAGPR84
SCHEMBL8372588 0.79 GSK3A (0.40) LOXL2KDM4EMAPTLMNAGPR84
SCHEMBL5014493 0.79 LOXL2 (0.39) LOXL2KDM4EMAPTLMNANPC1
SCHEMBL263790 0.77 LOXL2 (1.00) LOXL2KDM4EMAPTLMNANPC1
SCHEMBL3142657 0.76 KDM4E (0.41) LOXL2KDM4EMAPTLMNAGPR84
SCHEMBL12844167 0.76 GRM5 (0.40) LOXL2KDM4EMAPTLMNAGPR84
Hydrochloric Acid SCHEMBL3643761 0.75 LOXL2 (0.96) LOXL2KDM4EMAPTLMNANPC1
Hydrochloric Acid SCHEMBL1208908 0.75 LOXL2 (0.96) LOXL2KDM4EMAPTLMNANPC1
SCHEMBL31038391 0.75 LOXL2 (0.74) LOXL2DPP4KDM4EMAPTLMNA

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
US-20140315857-A1 N- (4 -QUINOLINYLMETHYL) SULFONAMIDE DERIVATIVES AND THEIR USE AS ANTHELMINTICS E. I. DUPONT DE NEMOURS AND COMPANY 2014-10-23 US disclosed
EP-2785694-A1 N- (4 -QUINOLINYLMETHYL) SULFONAMIDE DERIVATIVES AND THEIR USE AS ANTHELMINTICS E. I. Du Pont de Nemours and Company (US) 2014-10-08 EP disclosed
WO-2013081783-A1 N- (4 -QUINOLINYLMETHYL) SULFONAMIDE DERIVATIVES AND THEIR USE AS ANTHELMINTICS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2013-06-06 WO 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-20140315857-A1 N- (4 -QUINOLINYLMETHYL) SULFONAMIDE DERIVATIVES AND THEIR USE AS ANTHELMINTICS NQO2, SQOR, QSOX1 LOXL2 2936/4885DPP4 2390/4885KDM4E 1618/4885

“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.