SCHEMBL2947876

SCHEMBL2947876

CN(c1ccc2ncc(-c3cccs3)n2n1)C1CC1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FYN P06241 16/20 0.61
GRK5 P34947 1/20 0.56
LRRK2 Q5S007 2/20 0.46
CAMK2D Q13557 1/20 0.42
MITF O75030 1/20 0.40
ALDH1A1 P00352 1/20 0.40
PKM P14618 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL2949835 0.81 FYN (0.57) FYN
SCHEMBL2945294 0.81 FYN (0.38) FYNGRK5MITFALDH1A1PKM
SCHEMBL2943519 0.80 FYN (0.55) FYNCAMK2DMITFALDH1A1PKM
SCHEMBL2947648 0.79 FYN (0.61) FYNGRK5LRRK2
SCHEMBL2949657 0.77 SMN1; SMN2 (0.42) FYNMITFALDH1A1PKMSMN1; SMN2
SCHEMBL2944043 0.77 FYN (0.57) FYNGRK5LRRK2MITFALDH1A1
SCHEMBL2943238 0.77 FYN (0.59) FYN
SCHEMBL18613329 0.76 FYN (1.00) FYNGRK5LRRK2CAMK2D
SCHEMBL2947183 0.76 FYN (0.61) FYN
SCHEMBL2941584 0.76 FYN (0.56) FYN

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-7750000-B2 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments BAYER SCHERING PHARMA AG (DE) 2010-07-06 US disclosed
US-20070093490-A1 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments BAYER INTELLECTUAL PROPERTY GMBH (DE) 2007-04-26 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-20070093490-A1 Substituted imidazo[1,2b]pyridazines as kinase inhibitors, their preparation and use as medicaments MAP4K2, MAP3K1, MAP3K2 FYN 421/4885GRK5 212/4885LRRK2 691/4885

“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.