SCHEMBL534215

SCHEMBL534215

CCOc1nc(-c2cc[c]cc2)cs1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.39
CDC25A P30304 2/20 0.39
CDC25B P30305 2/20 0.39
CDC25C P30307 2/20 0.39
DUSP3 P51452 2/20 0.39
CYP19A1 P11511 1/20 0.39
MAPT P10636 5/20 0.37
ALDH1A1 P00352 4/20 0.37
GAA P10253 2/20 0.37
KDM4E B2RXH2 1/20 0.37
TP53 P04637 1/20 0.36
THRB P10828 1/20 0.36
RAB9A P51151 5/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
NPC1 O15118 3/20 0.35
POLB P06746 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 1/20 0.35
ALOX15 P16050 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
SCHEMBL533529 0.88 MAPT (0.46) MAPTRAB9AMEN1KMT2ANPC1
SCHEMBL533701 0.81 MAPT (0.45) ALOX5CYP19A1MAPTALDH1A1GAA
SCHEMBL532989 0.77 RAB9A (0.35) MAPTALDH1A1GAAKDM4ERAB9A
SCHEMBL533598 0.77 RAB9A (0.35) ALOX5MAPTALDH1A1GAAKDM4E
SCHEMBL533358 0.75 LOXL2 (0.44) MAPTALDH1A1GAAKDM4ERAB9A
SCHEMBL533569 0.74 ALDH1A1 (0.34) ALOX5MAPTALDH1A1GAAKDM4E
SCHEMBL533347 0.74 ALDH1A1 (0.34) ALOX5MAPTALDH1A1GAAKDM4E
SCHEMBL533303 0.74 ALDH1A1 (0.34) ALOX5MAPTALDH1A1GAAKDM4E
SCHEMBL533127 0.74 ALOX5 (0.39) ALOX5MAPTALDH1A1KDM4ERAB9A
SCHEMBL533154 0.72 LOXL2 (0.49) MAPTALDH1A1KDM4ERAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2415763-B1 PHARMACEUTICAL COMPOSITION FOR TREATING OR PREVENTING GLAUCOMA UBE INDUSTRIES (JP) 2016-01-27 EP disclosed
CN-103965099-A Pyridylaminoacetic Acid Compound UBE INDUSTRIES 2014-08-06 CN disclosed
CN-101970410-B Pyridylaminoacetic acid compounds UBE INDUSTRIES 2014-06-25 CN disclosed
US-20140113907-A1 PYRIDYLAMINOACETIC ACID COMPOUND UBE INDUSTRIES, LTD. (JP) 2014-04-24 US disclosed
US-8648097-B2 Pyridylaminoacetic acid compound UBE INDUSTRIES, LTD. (JP) 2014-02-11 US disclosed
US-20120190852-A1 MEDICAL COMPOSITION FOR TREATMENT OR PROPHYLAXIS OF GLAUCOMA UBE INDUSTRIES, LTD. (JP) 2012-07-26 US disclosed
CN-102448940-A Pharmaceutical composition for treating or preventing glaucoma UBE INDUSTRIES 2012-05-09 CN disclosed
EP-2415763-A1 PHARMACEUTICAL COMPOSITION FOR TREATING OR PREVENTING GLAUCOMA Ube Industries, Ltd. (JP) 2012-02-08 EP disclosed
US-20110054172-A1 PYRIDYLAMINOACETIC ACID COMPOUND UBE CORPORATION (JP) 2011-03-03 US disclosed
EP-2264009-A1 PYRIDYLAMINOACETIC ACID COMPOUND Ube Industries, Ltd. (JP) 2010-12-22 EP 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 (3 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-20140113907-A1 PYRIDYLAMINOACETIC ACID COMPOUND PTGER2, PTGER1, PTGDR2 ALOX5 134/4885CDC25A 2408/4885CDC25B 3357/4885
US-20110054172-A1 PYRIDYLAMINOACETIC ACID COMPOUND PTGER2, PTGER1, PTGDR2 ALOX5 157/4885CDC25A 2835/4885CDC25B 3520/4885
US-20120190852-A1 MEDICAL COMPOSITION FOR TREATMENT OR PROPHYLAXIS OF GLAUCOMA F12, C1S, AKR1C3 ALOX5 83/4885CDC25A 1681/4885CDC25B 2356/4885

“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.