SCHEMBL4831392

SCHEMBL4831392

CC(C)(C)OC(=O)CC(CCC(=O)NOC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)NCCc1ccc(-c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.43
CA9 Q16790 1/20 0.42
MMP2 P08253 6/20 0.41
MMP3 P08254 3/20 0.41
ESRRG P62508 1/20 0.40
MMEL1 Q495T6 1/20 0.39
MMP9 P14780 2/20 0.38
MMP8 P22894 2/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
KCNH2 Q12809 1/20 0.38
CTSK P43235 2/20 0.38
MMP1 P03956 1/20 0.38
MMP12 P39900 1/20 0.38
MMP14 P50281 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
CTSS P25774 1/20 0.38

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
SCHEMBL4839942 0.92 CA2 (0.45) CA2CA9MMP2MMP3ESRRG
SCHEMBL4840798 0.88 MMP2 (0.45) CA2CA9MMP2MMP3ESRRG
SCHEMBL4840314 0.85 CA2 (0.40) CA2CA9MMP2MMP3ESRRG
SCHEMBL4841261 0.85 ABCB1 (0.46) CA2CA9MMP2MMP3ESRRG
SCHEMBL4835699 0.83 SMN1; SMN2 (0.43) CA2CA9CYP3A4CYP2C9NPC1
SCHEMBL4831283 0.82 CA2 (0.49) CA2CA9MMP9MMP8CYP3A4
SCHEMBL4838858 0.82 CA2 (0.39) CA2CA9MMP3ESRRGKCNH2
SCHEMBL4838555 0.82 CA2 (0.42) CA2MMP2MMP3ESRRGMMEL1
SCHEMBL4835594 0.81 CYP3A4 (0.47) CA2CA9CYP3A4CYP2C9KCNH2
SCHEMBL4841231 0.81 MMEL1 (0.54) CA2CA9MMP2MMP3ESRRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7365091-B2 Derivatives of succinic and glutaric acids and analogs thereof useful as inhibitors of PHEX ENOBIA PHARMA (CA) 2008-04-29 US disclosed
US-20060287280-A1 Derivatives of succinic and glutaric acids and analogs thereof useful as inhibitors of PHEX ENOBIA PHARMA (CA) 2006-12-21 US disclosed
US-7105539-B2 Derivatives of succinic and glutaric acids and analogs thereof useful as inhibitors of phex ENOBIA PHARMA (CA) 2006-09-12 US disclosed
US-20060135480-A1 Derivatives of succinic and glutaric acids and analogs thereof useful as inhibitors of phex ENOBIA PHARMA (CA) 2006-06-22 US disclosed
EP-1572645-A2 DERIVATIVES OF SUCCINIC AND GLUTARIC ACIDS AND ANALOGS THEREOF USEFUL AS INHIBITORS OF PHEX Enobia Pharma Inc. (CA) 2005-09-14 EP disclosed
US-20040186301-A1 Derivatives of succinic and glutaric acids and analogs thereof useful as inhibitors of phex BIOMEP INC. 2004-09-23 US disclosed
WO-2004050620-A2 DERIVATIVES OF SUCCINIC AND GLUTARIC ACIDS AND ANALOGS THEREOF USEFUL AS INHIBITORS OF PHEX ENOBIA PHARMA (CA) 2004-06-17 WO 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 (3 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-20060287280-A1 Derivatives of succinic and glutaric acids and analogs thereof useful as inhibitors of PHEX GLS, SUCNR1, PGD CA2 333/4885CA9 776/4885MMP2 2325/4885
US-20040186301-A1 Derivatives of succinic and glutaric acids and analogs thereof useful as inhibitors of phex GLS, SUCNR1, PGD CA2 344/4885CA9 841/4885MMP2 2359/4885
US-20060135480-A1 Derivatives of succinic and glutaric acids and analogs thereof useful as inhibitors of phex GLS, SUCNR1, GCDH CA2 366/4885CA9 783/4885MMP2 2347/4885

“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.