SCHEMBL3868093

SCHEMBL3868093

CCOC(=O)c1cc2c(NC(=O)c3ccc(N4CCN(C)CC4)cc3)n[nH]c2s1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AURKA O14965 12/20 0.57
KIT P10721 4/20 0.53
FLT3 P36888 4/20 0.53
NTRK1 P04629 2/20 0.51
FGFR1 P11362 2/20 0.51
KDR P35968 1/20 0.51
INSR P06213 1/20 0.51
IGF1R P08069 1/20 0.51
AURKB Q96GD4 1/20 0.51
ALK Q9UM73 1/20 0.51

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
SCHEMBL740704 0.88 AURKA (0.56) AURKAKITFLT3NTRK1FGFR1
SCHEMBL3819108 0.87 AURKA (0.61) AURKAKITFLT3NTRK1FGFR1
SCHEMBL741230 0.87 AURKA (0.59) AURKAKITFLT3NTRK1FGFR1
Hydrochloric Acid SCHEMBL740993 0.86 AURKA (0.58) AURKAKITFLT3NTRK1FGFR1
SCHEMBL2417414 0.83 AURKA (0.65) AURKAKITFLT3NTRK1KDR
SCHEMBL13685830 0.82 AURKA (0.54) AURKAKITFLT3NTRK1FGFR1
SCHEMBL3817811 0.82 AURKA (0.57) AURKAKITFLT3NTRK1FGFR1
SCHEMBL2418296 0.82 AURKA (0.76) AURKAKITFLT3KDR
SCHEMBL3816332 0.81 AURKA (0.56) AURKAKITFLT3
SCHEMBL2416867 0.81 AURKA (0.61) AURKAKITFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7595320-B2 Hydrazinocarbonyl-thieno[2,3-C]pyrazoles, process for preparing them, compositions containing them and use thereof AVENTIS PHARMA S.A. (FR) 2009-09-29 US disclosed
US-20080146542-A1 Hydrazinocarbonyl-thieno[2,3-C]pyrazoles, Process for Preparing Them, Compositions Containing Them and Use Thereof AVENTIS PHARMA S.A. (FR) 2008-06-19 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-20080146542-A1 Hydrazinocarbonyl-thieno[2,3-C]pyrazoles, Process for Preparing Them, Compositions Containing Them and Use Thereof TP53, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CASP3 AURKA 519/4885KIT 138/4885FLT3 489/4885

“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.