SCHEMBL3705963

SCHEMBL3705963

CCOC(=O)/C(=C/N(C)C)n1cncn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.54
FAAH O00519 1/20 0.48
MGLL Q99685 1/20 0.48
MAPT P10636 8/20 0.45
SMN1; SMN2 Q16637 7/20 0.45
HTT P42858 6/20 0.45
HSP90AA1 P07900 2/20 0.45
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
CYP2C9 P11712 1/20 0.41
RAB9A P51151 5/20 0.39
PKM P14618 5/20 0.39
NPC1 O15118 4/20 0.39
MITF O75030 2/20 0.39
ATM Q13315 4/20 0.38
ALDH1A1 P00352 4/20 0.36
HPGD P15428 4/20 0.36
MAPK1 P28482 1/20 0.36
TP53 P04637 2/20 0.35
POLB P06746 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
SCHEMBL2571669 1.00 LMNA (0.54) LMNAFAAHMGLLMAPTSMN1; SMN2
SCHEMBL4807233 0.83 FAAH (0.46) LMNAFAAHMGLLMAPTSMN1; SMN2
SCHEMBL16589233 0.76 CYP2C9 (0.45) LMNAMAPTSMN1; SMN2HTTHSP90AA1
SCHEMBL10940657 0.75 MAPT (0.62) LMNAFAAHMGLLMAPTSMN1; SMN2
SCHEMBL10940669 0.75 MAPT (0.62) LMNAFAAHMGLLMAPTSMN1; SMN2
SCHEMBL14877230 0.75 FAAH (0.51) LMNAFAAHMGLLMAPTSMN1; SMN2
SCHEMBL14877232 0.75 FAAH (0.51) LMNAFAAHMGLLMAPTSMN1; SMN2
SCHEMBL22304265 0.74 FAAH (0.66) LMNAFAAHMGLLMAPTSMN1; SMN2
SCHEMBL564926 0.74 MAPT (0.45) LMNAMAPTSMN1; SMN2HTTHSP90AA1
SCHEMBL18381526 0.74 FAAH (0.48) LMNAFAAHMGLLMAPTSMN1; SMN2

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-20160229858-A1 SUBSTITUTED DIHYDROPYRAZOLONES FOR TREATING CARDIOVASCULAR AND HEMATOLOGICAL DISEASES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-08-11 US disclosed
US-9168249-B2 Substituted dihydropyrazolones for treating cardiovascular and hematological diseases BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-10-27 US disclosed
US-20150148381-A1 SUBSTITUTED DIHYDROPYRAZOLONES FOR TREATING CARDIOVASCULAR AND HEMATOLOGICAL DISEASES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-05-28 US disclosed
US-8987261-B2 Substituted dihydropyrazolones for treating cardiovascular and hematological diseases BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-03-24 US disclosed
US-8653111-B2 Substituted dihydropyrazolones for treating cardiovascular and hematological diseases BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-02-18 US disclosed
US-20140031329-A1 SUBSTITUTED DIHYDROPYRAZOLONES FOR TREATING CARDIOVASCULAR AND HEMATOLOGICAL DISEASES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-01-30 US disclosed
US-8389520-B2 Substituted dihydropyrazolones for treating cardiovascular and hematological diseases BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-03-05 US disclosed
US-20120121727-A1 SUBSTITUTED DIHYDROPYRAZOLONES FOR TREATING CARDIOVASCULAR AND HEMATOLOGICAL DISEASES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-05-17 US disclosed
US-20100305085-A1 SUBSTITUTED DIHYDROPYRAZOLONES FOR TREATING CARDIOVASCULAR AND HEMATOLOGICAL DISEASES BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-12-02 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 (5 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-20140031329-A1 SUBSTITUTED DIHYDROPYRAZOLONES FOR TREATING CARDIOVASCULAR AND HEMATOLOGICAL DISEASES THPO, PFKP, DCK LMNA 2722/4885FAAH 4768/4885MGLL 4740/4885
US-20160229858-A1 SUBSTITUTED DIHYDROPYRAZOLONES FOR TREATING CARDIOVASCULAR AND HEMATOLOGICAL DISEASES THPO, PFKP, DCK LMNA 2722/4885FAAH 4768/4885MGLL 4740/4885
US-20100305085-A1 SUBSTITUTED DIHYDROPYRAZOLONES FOR TREATING CARDIOVASCULAR AND HEMATOLOGICAL DISEASES THPO, PFKP, HPGDS LMNA 2522/4885FAAH 4583/4885MGLL 4690/4885
US-20120121727-A1 SUBSTITUTED DIHYDROPYRAZOLONES FOR TREATING CARDIOVASCULAR AND HEMATOLOGICAL DISEASES THPO, PFKP, DCK LMNA 2722/4885FAAH 4768/4885MGLL 4740/4885
US-20150148381-A1 SUBSTITUTED DIHYDROPYRAZOLONES FOR TREATING CARDIOVASCULAR AND HEMATOLOGICAL DISEASES THPO, PFKP, DCK LMNA 2722/4885FAAH 4768/4885MGLL 4740/4885

“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.