SCHEMBL4937843

SCHEMBL4937843

O=C(C1CC1)N1CCN(c2cnn(-c3ccc(Cl)cc3)c(=O)c2Cl)CC1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DCTPP1 Q9H773 4/20 0.58
ALDH1A1 P00352 7/20 0.55
SMN1; SMN2 Q16637 2/20 0.53
KDM4E B2RXH2 1/20 0.52
PKM P14618 1/20 0.52
CA12 O43570 3/20 0.50
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
CA9 Q16790 3/20 0.50
RXFP1 Q9HBX9 1/20 0.50
MAPT P10636 1/20 0.49
IDE P14735 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
MAPK1 P28482 1/20 0.47
GFER P55789 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
SCHEMBL4670530 0.87 DCTPP1 (0.65) DCTPP1ALDH1A1SMN1; SMN2KDM4EPKM
SCHEMBL4672611 0.86 DCTPP1 (0.64) DCTPP1ALDH1A1SMN1; SMN2KDM4EPKM
SCHEMBL14282225 0.82 NPBWR1 (0.51) DCTPP1ALDH1A1SMN1; SMN2RXFP1IDE
SCHEMBL14221005 0.81 DCTPP1 (0.64) DCTPP1ALDH1A1SMN1; SMN2KDM4EPKM
SCHEMBL13219453 0.80 ALDH1A1 (0.59) DCTPP1ALDH1A1SMN1; SMN2KDM4EPKM
SCHEMBL14282313 0.80 NPBWR1 (0.52) DCTPP1ALDH1A1SMN1; SMN2KDM4ERXFP1
SCHEMBL14282447 0.80 NPBWR1 (0.50) DCTPP1ALDH1A1SMN1; SMN2KDM4ERXFP1
SCHEMBL4675758 0.78 CA12 (0.56) DCTPP1ALDH1A1SMN1; SMN2CA12CA1
SCHEMBL4672310 0.78 DCTPP1 (0.62) DCTPP1ALDH1A1SMN1; SMN2KDM4EPKM
SCHEMBL14282453 0.77 NPBWR1 (0.44) DCTPP1ALDH1A1SMN1; SMN2RXFP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1497269-B1 SUBSTITUTED 2-PHENYL-3(2H)-PYRIDAZINONES BAYER HEALTHCARE AG (DE) 2008-04-23 EP disclosed
US-7320977-B2 Fibrotic disorders; disorders characterized by harmful buildup of collagen and/or by excessive lysyl oxidase enzymatic activity BAYER HEALTHCARE AG (DE) 2008-01-22 US disclosed
US-7320977-B2 Fibrotic disorders; disorders characterized by harmful buildup of collagen and/or by excessive lysyl oxidase enzymatic activity BAYER HEALTHCARE AG (DE) 2008-01-22 US disclosed
US-7320977-B2 Fibrotic disorders; disorders characterized by harmful buildup of collagen and/or by excessive lysyl oxidase enzymatic activity BAYER HEALTHCARE AG (DE) 2008-01-22 US disclosed
US-20060004015-A1 Substituted 2-phenyl-3(2h)-pyridazinones BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2006-01-05 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-20060004015-A1 Substituted 2-phenyl-3(2h)-pyridazinones PIR, TPMT, PNPO DCTPP1 703/4885ALDH1A1 655/4885SMN1; SMN2 1763/4885

“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.