SCHEMBL3501691

SCHEMBL3501691

CC/N=N\Nc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
TDP1 Q9NUW8 3/20 0.50
CYP1A1 P04798 1/20 0.50
CYP1B1 Q16678 1/20 0.50
RAB9A P51151 4/20 0.42
NPC1 O15118 3/20 0.42
MEN1 O00255 2/20 0.42
CASP3 P42574 2/20 0.42
KMT2A Q03164 2/20 0.42
SENP8 Q96LD8 2/20 0.42
SENP7 Q9BQF6 2/20 0.42
SENP6 Q9GZR1 2/20 0.42
NOX1 Q9Y5S8 1/20 0.39
ALDH1A1 P00352 6/20 0.39
GAA P10253 4/20 0.39
HPGD P15428 3/20 0.39
MAPT P10636 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 2/20 0.38
DEPTOR Q8TB45 1/20 0.38

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
SCHEMBL7898983 0.81 TDP1 (0.54) TSHRTDP1CYP1A1CYP1B1RAB9A
SCHEMBL2234039 0.81 TDP1 (0.43) TSHRTDP1CYP1A1CYP1B1RAB9A
SCHEMBL1278598 0.80 MAPT (0.43) TDP1RAB9ANPC1MEN1KMT2A
SCHEMBL10360876 0.80 MAPT (0.43) TDP1RAB9ANPC1MEN1KMT2A
SCHEMBL1278595 0.80 MAPT (0.43) TDP1RAB9ANPC1MEN1KMT2A
SCHEMBL7911594 0.77 TDP1 (0.50) TSHRTDP1CYP1A1CYP1B1RAB9A
SCHEMBL9055960 0.77 TDP1 (0.67) TSHRTDP1CYP1A1CYP1B1RAB9A
SCHEMBL9655458 0.77 EPHX1 (0.41) TSHRTDP1CYP1A1CYP1B1RAB9A
SCHEMBL9655455 0.77 EPHX1 (0.41) TSHRTDP1CYP1A1CYP1B1RAB9A
SCHEMBL2777926 0.76 TDP1 (0.48) TSHRTDP1CYP1A1CYP1B1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190046520-A1 QUINOLINONE LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA, INC. 2019-02-14 US disclosed
US-20160369237-A1 METHODS TO ACCELERATE THE ISOLATION OF NOVEL CELL STRAINS FROM PLURIPOTENT STEM CELLS AND CELLS OBTAINED THEREBY ADVANCED CELL TECH INC (US) 2016-12-22 US disclosed
US-20100184033-A1 METHODS TO ACCELERATE THE ISOLATION OF NOVEL CELL STRAINS FROM PLURIPOTENT STEM CELLS AND CELLS OBTAINED THEREBY Lineage Cell Therapeutics, Inc. 2010-07-22 US disclosed
US-20080226601-A1 Herpes Virus-Based Compositions and Methods of Use in the Prenatal and Perinatal Periods UNIVERSITY OF ROCHESTER (US) 2008-09-18 US disclosed
EP-1903873-A2 HERPES VIRUS-BASED COMPOSITIONS AND METHODS OF USE IN THE PRENATAL AND PERINATAL PERIODS THE UNIVERSITY OF ROCHESTER (US) 2008-04-02 EP disclosed
US-20080070303-A1 Using myocardial and/or muscle progenitor cells as modeling tool in tissue engineering; regenerative medicine and organ replacement ADVANCED CELL TECHNOLOGY 2008-03-20 US disclosed
WO-2006135602-A2 HERPES VIRUS-BASED COMPOSITIONS AND METHODS OF USE IN THE PRENATAL AND PERINATAL PERIODS UNIVERSITY OF ROCHESTER (US) 2006-12-21 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-20190046520-A1 QUINOLINONE LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF LOXL2, LOXL1, LOX TSHR 4769/4885TDP1 1201/4885CYP1A1 511/4885

“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.