SCHEMBL5651085

SCHEMBL5651085

CC(C)(C)c1ccc(CN[C@@H](CCC(N)=O)C(=O)OC(=O)c2ccc(-c3ccccc3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.43
LMNA P02545 1/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
KDM4E B2RXH2 1/20 0.42
NR1H4 Q96RI1 4/20 0.41
EPHX2 P34913 4/20 0.41
TNF P01375 1/20 0.41
KLF5 Q13887 1/20 0.41
NOD1 Q9Y239 1/20 0.41
MAPT P10636 1/20 0.41
PTGES O14684 1/20 0.40
ALOX5 P09917 1/20 0.40
EGFR P00533 1/20 0.40
ADCY6 O43306 1/20 0.40
ADCY3 O60266 1/20 0.40
ADCY9 O60503 1/20 0.40
ADCY5 O95622 1/20 0.40
ADCY8 P40145 1/20 0.40
GCGR P47871 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
SCHEMBL4369490 0.89 KDM4E (0.44) RAB9AKDM4EMAPTNPC1HDAC1
SCHEMBL5653527 0.86 SMN1; SMN2 (0.47) RAB9AKDM4ENPC1MMP2MMP9
SCHEMBL4359340 0.84 KDM4E (0.42) RAB9ALMNAKDM4ENR1H4EPHX2
SCHEMBL4361261 0.83 MGLL (0.46) LMNAKDM4E
SCHEMBL4365892 0.82 KDM4E (0.42) RAB9AKDM4ENPC1MMP2MMP9
SCHEMBL5654173 0.81 KDM4E (0.44) LMNAKDM4EEPHX2MMP2MMP9
SCHEMBL2251695 0.80 SMN1; SMN2 (0.45) LMNAKDM4EMAPTADAMTS4ADAMTS5
SCHEMBL5655905 0.80 KDM4E (0.42) KDM4EHDAC1MMP2MMP9
SCHEMBL2248048 0.79 EPHX2 (0.47) RAB9ALMNACA1CA2NR1H4
SCHEMBL5651555 0.78 KDM4E (0.51) RAB9ALMNAKDM4EMAPTEGFR

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-20070043066-A1 Glutamate aggrecanase inhibitors WYETH (US) 2007-02-22 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-20070043066-A1 Glutamate aggrecanase inhibitors ADAMTS5, ADAMTS1, ADAMTS7 RAB9A 3609/4885LMNA 4015/4885CA1 65/4885

“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.