SCHEMBL4288202

SCHEMBL4288202

OCc1cc2c(c3cc(Br)ccc13)CN(O)C=C2

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.38
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TSHR P16473 1/20 0.32
GFER P55789 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
MAPK8 P45983 1/20 0.31
RAD52 P43351 1/20 0.30
RECQL P46063 1/20 0.30

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
SCHEMBL4300829 0.73
SCHEMBL15558497 0.66 TRPA1 (0.33) TSHRGFER
SCHEMBL9475347 0.60 CHEK1 (0.50) CHEK1CYP1A2CYP2D6CYP2C9L3MBTL1
SCHEMBL4296233 0.57 CHEK1 (0.47) CHEK1MAPTLMNAMEN1KMT2A
SCHEMBL20312981 0.57 KMT2A (0.42) CHEK1MAPTLMNAL3MBTL1MEN1
SCHEMBL31514754 0.57 KMT2A (0.42) CHEK1MAPTLMNAL3MBTL1MEN1
SCHEMBL29417721 0.57 PTGDR2 (0.48) CHEK1MAPTLMNACYP1A2CYP2C9
SCHEMBL795719 0.57 PTGDR2 (0.48) CHEK1MAPTLMNACYP1A2CYP2C9
SCHEMBL135165 0.56 PTGDR2 (0.49) MAPTLMNAMEN1KMT2A
SCHEMBL507839 0.56 PYCR1 (0.46) CYP1A2CYP2C9MEN1KMT2A

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-20090258852-A1 Inhibitors of Checkpoint Kinases MERCK SHARP & DOHME CORP. 2009-10-15 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-20090258852-A1 Inhibitors of Checkpoint Kinases CHEK1, CHEK2, CDKN1A CHEK1 1/4885MAPT 3674/4885LMNA 2406/4885

“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.