SCHEMBL3829149

SCHEMBL3829149

NNc1nnc(-c2ccc(F)cc2)s1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.51
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
CSNK2A2 P19784 1/20 0.51
CSNK2A1 P68400 1/20 0.51
KDM4E B2RXH2 7/20 0.49
RAB9A P51151 6/20 0.49
NPC1 O15118 5/20 0.49
HDAC1 Q13547 2/20 0.48
HDAC2 Q92769 1/20 0.48
MAPT P10636 4/20 0.47
CYP1A2 P05177 2/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2D6 P10635 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
PSMD14 O00487 1/20 0.47
HTT P42858 1/20 0.47
BLM P54132 1/20 0.47
MCL1 Q07820 1/20 0.47

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
SCHEMBL3825832 0.81 KDM4E (0.61) SMN1; SMN2KMT2AMEN1KDM4ERAB9A
SCHEMBL13105216 0.81 KDM4E (0.65) SMN1; SMN2KMT2AMEN1CSNK2A2CSNK2A1
SCHEMBL20214047 0.80 HDAC1 (0.51) KDM4ERAB9ANPC1HDAC1HDAC2
SCHEMBL3334264 0.80 CA1 (0.61) SMN1; SMN2KMT2AMEN1CSNK2A2CSNK2A1
SCHEMBL22761303 0.77 KDM4E (0.73) SMN1; SMN2KMT2AMEN1CSNK2A2CSNK2A1
SCHEMBL12882390 0.77 SMN1; SMN2 (0.55) SMN1; SMN2KMT2AMEN1CSNK2A2CSNK2A1
SCHEMBL1143313 0.76 KDM4E (0.66) SMN1; SMN2CSNK2A2CSNK2A1KDM4ERAB9A
SCHEMBL28573287 0.75 PIK3CD (0.60) SMN1; SMN2KMT2AMEN1CSNK2A2CSNK2A1
SCHEMBL11935946 0.74 PIM1 (0.45) SMN1; SMN2KMT2AMEN1CSNK2A2CSNK2A1
SCHEMBL3826842 0.74 HDAC1 (0.44) SMN1; SMN2KMT2AMEN1CSNK2A2CSNK2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030072725-A1 Topical cosmetic agents containing 2-hydrazino-1,3 -heteroazoles HAARMANN & REIMER GMBH (DE) 2003-04-17 US claimed
US-20020128268-A1 Use of 2-hydrazino-1,3-thiazoles as antioxidants HAARMANN & REIMER GMBH (DE) 2002-09-12 US claimed
EP-2089380-B1 SUBSTITUTED DIHYDROPYRAZOLONES AND USE THEREOF AS HIF-PROLYL-4 -HYDROXYLASE INHIBITORS BAYER IP GMBH (DE) 2016-06-29 EP disclosed
CN-101541785-B Substituted dihydropyrazolones and use thereof as HIF-prolyl-4 -hydroxylase inhibitors BAYER IP GMBH 2014-03-12 CN disclosed
US-8524699-B2 Substituted dihydropyrazolones and use thereof as HIF-prolyl-4-hydroxylase inhibitors BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-09-03 US disclosed
US-20120264704-A1 SUBSTITUTED DIHYDROPYRAZOLONES AND USE THEREOF AS HIF-PROLYL-4 -HYDROXYLASE INHIBITORS BAYER SCHERING PHARMA AG (DE) 2012-10-18 US disclosed
EP-2089380-A1 SUBSTITUTED DIHYDROPYRAZOLONES AND USE THEREOF AS HIF-PROLYL-4 -HYDROXYLASE INHIBITORS Bayer Schering Pharma AG (DE) 2009-08-19 EP disclosed
WO-2008049538-A1 SUBSTITUTED DIHYDROPYRAZOLONES AND USE THEREOF AS HIF-PROLYL-4 -HYDROXYLASE INHIBITORS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-05-02 WO disclosed
US-20030072725-A1 Topical cosmetic agents containing 2-hydrazino-1,3 -heteroazoles HAARMANN & REIMER GMBH (DE) 2003-04-17 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-20020128268-A1 Use of 2-hydrazino-1,3-thiazoles as antioxidants GPX1, LPO, GPX4 SMN1; SMN2 3373/4885KMT2A 2412/4885MEN1 3618/4885
US-20120264704-A1 SUBSTITUTED DIHYDROPYRAZOLONES AND USE THEREOF AS HIF-PROLYL-4 -HYDROXYLASE INHIBITORS HIF1AN, EGLN3, EGLN2 SMN1; SMN2 4495/4885KMT2A 804/4885MEN1 4453/4885
US-20030072725-A1 Topical cosmetic agents containing 2-hydrazino-1,3 -heteroazoles TYR, MITF, HDAC1 SMN1; SMN2 4816/4885KMT2A 639/4885MEN1 3442/4885

“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.