SCHEMBL14693792

SCHEMBL14693792

O=C(Nc1ccc(Cl)nc1Cl)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 8/20 0.62
▸ RAB9A P51151 4/20 0.60
▸ NPC1 O15118 3/20 0.60
▸ POLB P06746 2/20 0.59
▸ CACNA1B Q00975 1/20 0.59
▸ APBA1 Q02410 1/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ MEN1 O00255 7/20 0.59
▸ KDR P35968 1/20 0.59
▸ IRAK4 Q9NWZ3 1/20 0.56
▸ ALDH1A1 P00352 1/20 0.56
▸ MAPT P10636 4/20 0.55
▸ TDP1 Q9NUW8 1/20 0.55
▸ LMNA P02545 2/20 0.54
▸ BLM P54132 1/20 0.54
▸ PABPC1 P11940 1/20 0.54
▸ DUSP3 P51452 1/20 0.54
▸ PTPN5 P54829 1/20 0.54
▸ PTPN11 Q06124 1/20 0.54
▸ EIF4H Q15056 1/20 0.54

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
SCHEMBL14693849 0.84 NPC1 (0.55) KMT2ARAB9ANPC1POLBSMN1; SMN2
SCHEMBL14693923 0.81 GRM5 (0.65) KMT2ARAB9ANPC1SMN1; SMN2MEN1
SCHEMBL14693968 0.79 KMT2A (0.67) KMT2ARAB9ANPC1POLBMEN1
SCHEMBL14693863 0.79 KCNQ3 (0.60) KMT2ARAB9ANPC1SMN1; SMN2MEN1
SCHEMBL12750400 0.78 KCNQ3 (0.54) KMT2ARAB9ANPC1POLBMEN1
SCHEMBL9767122 0.78 RAB9A (0.71) KMT2ARAB9ANPC1POLBCACNA1B
SCHEMBL18146518 0.78 KMT2A (0.62) KMT2ARAB9ANPC1POLBCACNA1B
SCHEMBL14693882 0.76 GRM5 (0.55) KMT2AMEN1IRAK4
SCHEMBL30641944 0.75 RAB9A (0.60) KMT2ARAB9ANPC1POLBCACNA1B
SCHEMBL27704227 0.75 RAB9A (0.60) KMT2ARAB9ANPC1POLBCACNA1B

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-2560008-B1 Pharmaceutical compositions for preventing or treating degenerative brain disease and method of screening the same KOREA INST SCI & TECH (KR) 2016-11-30 — — EP disclosed
EP-2560008-B1 Pharmaceutical compositions for preventing or treating degenerative brain disease and method of screening the same KOREA INST SCI & TECH (KR) 2016-11-30 — — EP disclosed
US-9469653-B2 Pharmaceutical compositions for preventing or treating degenerative brain disease and method of screening the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2016-10-18 — — US disclosed
US-9469653-B2 Pharmaceutical compositions for preventing or treating degenerative brain disease and method of screening the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2016-10-18 — — US disclosed
US-20140142089-A1 PHARMACEUTICAL COMPOSITIONS FOR PREVENTING OR TREATING DEGENERATIVE BRAIN DISEASE AND METHOD OF SCREENING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2014-05-22 — — US disclosed
US-20140142089-A1 PHARMACEUTICAL COMPOSITIONS FOR PREVENTING OR TREATING DEGENERATIVE BRAIN DISEASE AND METHOD OF SCREENING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2014-05-22 — — US disclosed
US-20130046093-A1 PHARMACEUTICAL COMPOSITIONS FOR PREVENTING OR TREATING DEGENERATIVE BRAIN DISEASE AND METHOD OF SCREENING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-02-21 — — US disclosed
US-20130046093-A1 PHARMACEUTICAL COMPOSITIONS FOR PREVENTING OR TREATING DEGENERATIVE BRAIN DISEASE AND METHOD OF SCREENING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-02-21 — — US disclosed
EP-2560008-A2 Pharmaceutical compositions for preventing or treating degenerative brain disease and method of screening the same Korea Institute of Science and Technology (KR) 2013-02-20 — — EP disclosed
EP-2560008-A2 Pharmaceutical compositions for preventing or treating degenerative brain disease and method of screening the same Korea Institute of Science and Technology (KR) 2013-02-20 — — 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 (2 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-20140142089-A1 PHARMACEUTICAL COMPOSITIONS FOR PREVENTING OR TREATING DEGENERATIVE BRAIN DISEASE AND METHOD OF SCREENING THE SAME PSEN2, PSEN1, GRN KMT2A 4162/4885RAB9A 3634/4885NPC1 112/4885
US-20130046093-A1 PHARMACEUTICAL COMPOSITIONS FOR PREVENTING OR TREATING DEGENERATIVE BRAIN DISEASE AND METHOD OF SCREENING THE SAME PSEN2, PSEN1, GRN KMT2A 4162/4885RAB9A 3634/4885NPC1 112/4885

“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.

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