SCHEMBL29328693

SCHEMBL29328693

CNc1ccc(NC)c2c1CCCC2=O

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 13/20 0.38
ALDH1A1 P00352 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPT P10636 3/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
CREBBP Q92793 1/20 0.35
EGFR P00533 1/20 0.34
PABPC1 P11940 1/20 0.34
MAPK1 P28482 1/20 0.34
RAB9A P51151 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL22519655 0.86 BRD4 (0.40) BRD4ALDH1A1SMN1; SMN2MAPTNPSR1
SCHEMBL24313114 0.81 ANO1 (0.37) SMN1; SMN2MAPT
SCHEMBL7652191 0.75 BAZ2B (0.44) BRD4ALDH1A1MAPTNPSR1KDM4E
SCHEMBL8312077 0.74 CYP2A6 (0.44) BRD4ALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL7098664 0.69 BRD4 (0.43) BRD4KDM4EHPGDKMT2ACREBBP
SCHEMBL24327623 0.68 HTR2C (0.33) KDM4E
SCHEMBL22463098 0.67 BAZ2B (0.40) BRD4ALDH1A1MAPTKDM4EHPGD
SCHEMBL7098540 0.67 BRD4 (0.40) BRD4KDM4EHPGDCREBBP
SCHEMBL7658479 0.67 BRD4 (0.41) BRD4ALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL7653318 0.67 BAZ2B (0.40) BRD4ALDH1A1MAPTKDM4EMEN1

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-20240239894-A1 THERAPEUTIC BINDING MOLECULES MEDIMMUNE LIMITED (GB) 2024-07-18 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-20240239894-A1 THERAPEUTIC BINDING MOLECULES EPCAM, IGSF11, FCGR3B BRD4 691/4885ALDH1A1 1539/4885SMN1; SMN2 4645/4885

“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.