SCHEMBL14814647

SCHEMBL14814647

CC(O)(c1ccncc1)c1cnc(-c2ccc(F)cc2)o1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.46
USP2 O75604 1/20 0.46
NPC1 O15118 5/20 0.42
HPGD P15428 3/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
TP53 P04637 2/20 0.42
MEN1 O00255 1/20 0.42
GAA P10253 1/20 0.42
STAT1 P42224 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MAPK14 Q16539 5/20 0.39
MAPK13 O15264 2/20 0.39
MAPK12 P53778 2/20 0.39
MAPK11 Q15759 2/20 0.39
GCGR P47871 2/20 0.39
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL18624161 0.86 RAB9A (0.38) RAB9AUSP2NPC1HPGDKDM4E
SCHEMBL14837997 0.85 RAB9A (0.44) RAB9AUSP2NPC1HPGDKDM4E
SCHEMBL14814895 0.80 RAB9A (0.46) RAB9AUSP2NPC1KDM4EALDH1A1
SCHEMBL14814305 0.79 RAB9A (0.49) RAB9AUSP2NPC1KDM4EALDH1A1
SCHEMBL14814430 0.77 CREBBP (0.41) RAB9ANPC1HPGDKDM4EALDH1A1
SCHEMBL11684104 0.76 USP2 (0.70) RAB9AUSP2KDM4EALDH1A1MEN1
SCHEMBL14814451 0.75 USP2 (0.47) RAB9AUSP2MAPK14MAPK13MAPK12
SCHEMBL14814120 0.75 RAB9A (0.48) RAB9AUSP2NPC1HPGDALDH1A1
SCHEMBL14814192 0.75 USP2 (0.44) RAB9AUSP2HPGDKDM4EALDH1A1
SCHEMBL14814067 0.75 RAB9A (0.44) RAB9AUSP2NPC1HPGDKDM4E

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8809372-B2 Pyridine derivatives ASANA BIOSCIENCES, LLC (US) 2014-08-19 US claimed
US-20130085148-A1 Pyridine Derivatives ENDO PHARMACEUTICALS INC. (US) 2013-04-04 US claimed
US-20170073339-A1 PYRIDINE DERIVATIVES ENDO PHARMACEUTICALS, INC. 2017-03-16 US disclosed
US-20170073339-A1 PYRIDINE DERIVATIVES ENDO PHARMACEUTICALS, INC. 2017-03-16 US disclosed
US-20170073339-A1 PYRIDINE DERIVATIVES ENDO PHARMACEUTICALS, INC. 2017-03-16 US disclosed
US-9533981-B2 Pyridine derivatives ASANA BIOSCIENCES, LLC (US) 2017-01-03 US disclosed
US-9533981-B2 Pyridine derivatives ASANA BIOSCIENCES, LLC (US) 2017-01-03 US disclosed
US-20160340310-A9 Pyridine Derivatives ENDO PHARMACEUTICALS, INC. 2016-11-24 US disclosed
US-20160340310-A9 Pyridine Derivatives ENDO PHARMACEUTICALS, INC. 2016-11-24 US disclosed
US-20160340310-A9 Pyridine Derivatives ENDO PHARMACEUTICALS, INC. 2016-11-24 US disclosed
US-9371316-B2 Pyridine derivatives ASANA BIOSCIENCES, LLC (US) 2016-06-21 US disclosed
US-8809372-B2 Pyridine derivatives ASANA BIOSCIENCES, LLC (US) 2014-08-19 US disclosed
US-8809372-B2 Pyridine derivatives ASANA BIOSCIENCES, LLC (US) 2014-08-19 US disclosed
US-8809372-B2 Pyridine derivatives ASANA BIOSCIENCES, LLC (US) 2014-08-19 US disclosed
EP-2760833-A1 PYRIDINE DERIVATIVES Endo Pharmaceuticals Inc. (US) 2014-08-06 EP disclosed
WO-2013049559-A1 PYRIDINE DERIVATIVES ENDO PHARMACEUTICALS INC. (US) 2013-04-04 WO disclosed
WO-2013049559-A1 PYRIDINE DERIVATIVES ENDO PHARMACEUTICALS INC. (US) 2013-04-04 WO disclosed
US-20130085148-A1 Pyridine Derivatives ENDO PHARMACEUTICALS INC. (US) 2013-04-04 US disclosed
US-20130085148-A1 Pyridine Derivatives ENDO PHARMACEUTICALS INC. (US) 2013-04-04 US disclosed
US-20130085148-A1 Pyridine Derivatives ENDO PHARMACEUTICALS INC. (US) 2013-04-04 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 (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-20130085148-A1 Pyridine Derivatives CYP2A7, CYP21A2, CYP3A7 RAB9A 3164/4885USP2 1959/4885NPC1 2147/4885
US-20170073339-A1 PYRIDINE DERIVATIVES CYP21A2, CYP26A1, CYP11B1 RAB9A 3120/4885USP2 2767/4885NPC1 2391/4885
US-20160340310-A9 Pyridine Derivatives CYP2A7, CYP21A2, CYP3A7 RAB9A 3164/4885USP2 1959/4885NPC1 2147/4885

“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.