SCHEMBL4151719

SCHEMBL4151719

Oc1ccc(-c2cncc(NCc3cccc(Cl)c3)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FYN P06241 2/20 0.51
CCNT1 O60563 1/20 0.45
CDK9 P50750 1/20 0.45
XDH P47989 1/20 0.44
SLC22A12 Q96S37 1/20 0.44
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
PKM P14618 1/20 0.43
RAB9A P51151 1/20 0.43
BLM P54132 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL4138960 0.88 FYN (0.60) FYNCCNT1CDK9KDM4EMEN1
SCHEMBL4160318 0.87 ROCK2 (0.48) FYNCCNT1CDK9HDAC3HDAC1
SCHEMBL4160467 0.85 FYN (0.48) FYNXDHSLC22A12HDAC1KDM4E
SCHEMBL4144178 0.83 FYN (0.46) FYNCCNT1CDK9XDHSLC22A12
SCHEMBL4156602 0.81 FYN (0.51) FYNCCNT1CDK9XDHSLC22A12
SCHEMBL4140694 0.81 FYN (0.46) FYNCCNT1CDK9XDHSLC22A12
SCHEMBL4146617 0.80 FYN (0.64) FYNCCNT1CDK9KDM4EMEN1
SCHEMBL4148055 0.80 FYN (0.57) FYNCCNT1CDK9KDM4EMEN1
SCHEMBL4191754 0.80 FYN (0.57) FYNCCNT1CDK9KDM4EMAPT
SCHEMBL4149226 0.80 INSR (0.49) FYNKDM4EMEN1ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090163515-A1 Compounds Which Bind to the Active Site of Protein Kinase Enzymes BIOFOCUS DISCOVERY LTD. 2009-06-25 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-20090163515-A1 Compounds Which Bind to the Active Site of Protein Kinase Enzymes ROCK1, ROCK2, CIT FYN 114/4885CCNT1 3712/4885CDK9 587/4885

“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.