SCHEMBL2888962

SCHEMBL2888962

Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 12/20 0.59
LRRK2 Q5S007 1/20 0.58
MAPT P10636 2/20 0.58
BRAF P15056 2/20 0.58
KDM4E B2RXH2 1/20 0.58
ALDH1A1 P00352 1/20 0.58
RAF1 P04049 1/20 0.58
TP53 P04637 1/20 0.58
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2C9 P11712 1/20 0.58
HPGD P15428 1/20 0.58
ALOX15 P16050 1/20 0.58
MAPK11 Q15759 1/20 0.58
HSD17B10 Q99714 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
CYP19A1 P11511 2/20 0.58
SMO Q99835 2/20 0.55
MEN1 O00255 3/20 0.53

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
SCHEMBL6526624 0.86 MAPK14 (0.65) MAPK14LRRK2MAPTBRAFKDM4E
SCHEMBL6476701 0.85 MAPK14 (0.79) MAPK14LRRK2MAPTBRAFKDM4E
SCHEMBL2888954 0.84 NPC1 (0.52) MAPK14MAPTBRAFKDM4EALDH1A1
SCHEMBL2887115 0.81 BRAF (0.55) MAPK14MAPTBRAFKDM4EALDH1A1
SCHEMBL2963776 0.79 MAPK14 (0.68) MAPK14LRRK2MAPTBRAFKDM4E
SCHEMBL27481232 0.79 MEN1 (0.58) MAPK14LRRK2MAPTBRAFKDM4E
SCHEMBL13198146 0.78 MAPK14 (0.61) MAPK14MAPTBRAFKDM4EALDH1A1
SCHEMBL2891790 0.77 MAPK14 (0.70) MAPK14MAPTBRAFKDM4EALDH1A1
SCHEMBL11548021 0.76 NPC1 (0.68) KDM4ECYP19A1MEN1KMT2A
SCHEMBL8970557 0.76 KCNK3 (0.70) MAPK14MAPTBRAFKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100197688-A1 EPHA4 RTK INHIBITORS FOR TREATMENT OF NEUROLOGICAL AND NEURODEGENERATIVE DISORDERS AND CANCER MSD K.K. (JP) 2010-08-05 US disclosed
US-20100197688-A1 EPHA4 RTK INHIBITORS FOR TREATMENT OF NEUROLOGICAL AND NEURODEGENERATIVE DISORDERS AND CANCER MSD K.K. (JP) 2010-08-05 US disclosed
US-20100197688-A1 EPHA4 RTK INHIBITORS FOR TREATMENT OF NEUROLOGICAL AND NEURODEGENERATIVE DISORDERS AND CANCER MSD K.K. (JP) 2010-08-05 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-20100197688-A1 EPHA4 RTK INHIBITORS FOR TREATMENT OF NEUROLOGICAL AND NEURODEGENERATIVE DISORDERS AND CANCER EPHA4, EPHA1, ERBB4 MAPK14 146/4885LRRK2 715/4885MAPT 349/4885

“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.