SCHEMBL15844951

SCHEMBL15844951

c1cnc2ccc(-c3nc4ccccc4o3)cc2c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 10/20 0.63
ALDH1A1 P00352 10/20 0.63
RAB9A P51151 8/20 0.63
KDM4E B2RXH2 8/20 0.63
HPGD P15428 8/20 0.63
SMN1; SMN2 Q16637 6/20 0.63
HSD17B10 Q99714 5/20 0.63
MAPT P10636 4/20 0.63
HCRTR1 O43613 3/20 0.63
USP2 O75604 1/20 0.63
TSHR P16473 1/20 0.63
MAPK1 P28482 1/20 0.63
CASP3 P42574 1/20 0.63
NPSR1 Q6W5P4 1/20 0.63
SENP8 Q96LD8 1/20 0.63
SENP7 Q9BQF6 1/20 0.63
SENP6 Q9GZR1 1/20 0.63
POLB P06746 1/20 0.59
TP53 P04637 6/20 0.58
UTRN P46939 2/20 0.56

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
SCHEMBL13621010 0.88 NPC1 (0.54) NPC1ALDH1A1RAB9AKDM4EHPGD
SCHEMBL18553033 0.86 ALDH1A1 (0.58) NPC1ALDH1A1RAB9AKDM4EHPGD
SCHEMBL18500358 0.84 NPC1 (0.56) NPC1ALDH1A1RAB9AKDM4EHPGD
SCHEMBL15845073 0.84 RAB9A (0.58) NPC1ALDH1A1RAB9AKDM4EHPGD
SCHEMBL4056655 0.84 UTRN (0.56) NPC1ALDH1A1RAB9AKDM4EHPGD
SCHEMBL15844590 0.83 UTRN (0.56) NPC1ALDH1A1RAB9AKDM4EHPGD
SCHEMBL30727501 0.82 NPC1 (0.62) NPC1ALDH1A1RAB9AKDM4EHPGD
SCHEMBL1913541 0.82 NPC1 (0.62) NPC1ALDH1A1RAB9AKDM4EHPGD
SCHEMBL2174585 0.82 NPC1 (0.66) NPC1ALDH1A1RAB9AKDM4EHPGD
SCHEMBL4059650 0.82 VSIR (0.54) NPC1ALDH1A1RAB9AKDM4EHPGD

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2774923-B1 METHOD FOR PRODUCING PHENYL-SUBSTITUTED HETEROCYCLIC DERIVATIVE UNIV NAGOYA NAT UNIV CORP (JP) 2016-05-18 EP disclosed
EP-2774923-B1 METHOD FOR PRODUCING PHENYL-SUBSTITUTED HETEROCYCLIC DERIVATIVE UNIV NAGOYA NAT UNIV CORP (JP) 2016-05-18 EP disclosed
US-9246108-B2 Quinoline-benzoxazole derived compounds for electronic films and devices DOW GLOBAL TECHNOLOGIES LLC (US) 2016-01-26 US disclosed
US-8993777-B2 Method for producing phenyl-substituted heterocyclic derivative NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2015-03-31 US disclosed
US-8993777-B2 Method for producing phenyl-substituted heterocyclic derivative NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2015-03-31 US disclosed
US-8993777-B2 Method for producing phenyl-substituted heterocyclic derivative NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2015-03-31 US disclosed
US-20140275549-A1 METHOD FOR PRODUCING PHENYL-SUBSTITUTED HETEROCYCLIC DERIVATIVE NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2014-09-18 US disclosed
US-20140275549-A1 METHOD FOR PRODUCING PHENYL-SUBSTITUTED HETEROCYCLIC DERIVATIVE NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2014-09-18 US disclosed
US-20140275549-A1 METHOD FOR PRODUCING PHENYL-SUBSTITUTED HETEROCYCLIC DERIVATIVE NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2014-09-18 US disclosed
EP-2774923-A1 METHOD FOR PRODUCING PHENYL-SUBSTITUTED HETEROCYCLIC DERIVATIVE National University Corporation Nagoya University (JP) 2014-09-10 EP disclosed
EP-2774923-A1 METHOD FOR PRODUCING PHENYL-SUBSTITUTED HETEROCYCLIC DERIVATIVE National University Corporation Nagoya University (JP) 2014-09-10 EP disclosed
CN-103915574-A QUINOLINE-BENZOXAZOLE DERIVED COMPOUNDS FOR ELECTRONIC FILMS AND DEVICES DOW GLOBAL TECHNOLOGIES LLC 2014-07-09 CN disclosed
US-20140183413-A1 QUINOLINE-BENZOXAZOLE DERIVED COMPOUNDS FOR ELECTRONIC FILMS AND DEVICES DOW GLOBAL TECHNOLOGIES LLC (US) 2014-07-03 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 (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-20140275549-A1 METHOD FOR PRODUCING PHENYL-SUBSTITUTED HETEROCYCLIC DERIVATIVE PAH, DDT, NISCH NPC1 1346/4885ALDH1A1 1162/4885RAB9A 2878/4885

“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.