SCHEMBL2630604

SCHEMBL2630604

O=c1[nH]c2cc3nc(-c4ccccc4)c(=O)[nH]c3cc2nc1-c1ccccc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.74
NPC1 O15118 5/20 0.74
KDM4E B2RXH2 4/20 0.74
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
POLB P06746 2/20 0.49
MAPT P10636 1/20 0.49
PABPC1 P11940 1/20 0.49
GRIN2D O15399 1/20 0.48
GRIN3B O60391 1/20 0.48
GRIN1 Q05586 1/20 0.48
GRIN2A Q12879 1/20 0.48
GRIN2B Q13224 1/20 0.48
GRIN2C Q14957 1/20 0.48
GRIN3A Q8TCU5 1/20 0.48
HSD17B10 Q99714 2/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
XDH P47989 5/20 0.45

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
SCHEMBL29101810 0.89 RAB9A (0.64) RAB9ANPC1KDM4EMEN1KMT2A
SCHEMBL8873758 0.89 KDM4E (0.64) RAB9ANPC1KDM4EMEN1KMT2A
SCHEMBL29820118 0.85 RAB9A (1.00) RAB9ANPC1KDM4EMEN1KMT2A
SCHEMBL1901480 0.85 RAB9A (1.00) RAB9ANPC1KDM4EMEN1KMT2A
SCHEMBL29101816 0.84 KDM4E (0.67) RAB9ANPC1KDM4EMEN1KMT2A
SCHEMBL30637068 0.84 KDM4E (0.68) RAB9ANPC1KDM4EMEN1KMT2A
SCHEMBL29101814 0.84 KDM4E (0.68) RAB9ANPC1KDM4EMEN1KMT2A
SCHEMBL30637067 0.84 KDM4E (0.67) RAB9ANPC1KDM4EMEN1KMT2A
SCHEMBL31038403 0.81 KDM4E (0.63) RAB9ANPC1KDM4EALDH1A1HPGD
SCHEMBL20456897 0.81 KDM4E (0.63) RAB9ANPC1KDM4EALDH1A1HPGD

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
US-8177901-B2 Porous inorganic materials of silcon and oxygen BASF SE Ludwigshafen (DE) 2012-05-15 US disclosed
US-8177901-B2 Porous inorganic materials of silcon and oxygen BASF SE Ludwigshafen (DE) 2012-05-15 US disclosed
US-20120100395-A1 INDICATOR SYSTEM FOR MONITORING A STERILIZATION PROCESS BASF SE (DE) 2012-04-26 US disclosed
WO-2010128063-A2 INDICATOR SYSTEM FOR MONITORING A STERILIZATION PROCESS BASF SE (DE) 2010-11-11 WO disclosed
US-20100003520-A1 POROUS INORGANIC MATERIALS OF SILCON AND OXYGEN BUJARD PATRICE 2010-01-07 US disclosed
US-20100003520-A1 POROUS INORGANIC MATERIALS OF SILCON AND OXYGEN BUJARD PATRICE 2010-01-07 US disclosed
US-7594962-B2 vapor-deposition of a separating agent (NaCl) onto Al carrier to produce a separating agent layer,simultaneous vapor-deposition of SiO and NaCl onto the NaCl layer, separating SiO, converted to SiO2 by oxidizing with O2, filling pores of SiO2 with TiO2, Fe2O3, Indium tin oxide etc. CIBA SPECIALTY CHEMICALS CORPORATION (US) 2009-09-29 US disclosed
US-7594962-B2 vapor-deposition of a separating agent (NaCl) onto Al carrier to produce a separating agent layer,simultaneous vapor-deposition of SiO and NaCl onto the NaCl layer, separating SiO, converted to SiO2 by oxidizing with O2, filling pores of SiO2 with TiO2, Fe2O3, Indium tin oxide etc. CIBA SPECIALTY CHEMICALS CORPORATION (US) 2009-09-29 US disclosed
US-20080319089-A1 Method of colouring carrier materials MULLER MARTIN 2008-12-25 US disclosed
US-20080319089-A1 Method of colouring carrier materials MULLER MARTIN 2008-12-25 US disclosed
EP-1549714-B1 METHOD OF COLOURING CARRIER MATERIALS CIBA HOLDING INC (CH) 2008-10-29 EP disclosed
US-20070051275-A1 Method of colouring carrier materials CIBA SPECIALTY CHEMICALS CORP. 2007-03-08 US disclosed
US-20070051275-A1 Method of colouring carrier materials CIBA SPECIALTY CHEMICALS CORP. 2007-03-08 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-20080319089-A1 Method of colouring carrier materials CRYAA, SLC67A1, SOD3 RAB9A 1523/4885NPC1 654/4885KDM4E 4338/4885

“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.