SCHEMBL4842426

SCHEMBL4842426

COC(=O)CNC(CC(=O)OC(C)(C)C)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 2/20 0.55
CTSL P07711 2/20 0.54
REN P00797 2/20 0.53
CTSS P25774 1/20 0.52
CTSK P43235 1/20 0.52
MAPT P10636 2/20 0.50
TP53 P04637 1/20 0.50
MEN1 O00255 1/20 0.49
HCRTR1 O43613 1/20 0.49
KMT2A Q03164 1/20 0.49
MMP1 P03956 4/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ACE P12821 1/20 0.48
CCKBR P32239 1/20 0.48
IL1RN P18510 1/20 0.47
ERAP2 Q6P179 1/20 0.47

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
SCHEMBL6255378 0.94 TACR1 (0.54) TACR1CTSLRENCTSSCTSK
SCHEMBL6430686 0.86 TACR1 (0.56) TACR1CTSLCTSSCTSKMAPT
SCHEMBL4842487 0.85 TACR1 (0.56) TACR1CTSLRENCTSSCTSK
SCHEMBL7430601 0.83 TACR1 (0.58) TACR1CTSLCTSSCTSKMAPT
SCHEMBL7430608 0.83 TACR1 (0.58) TACR1CTSLCTSSCTSKMAPT
SCHEMBL7433229 0.82 PKM (0.56) TACR1CTSLCTSSCTSKMAPT
SCHEMBL7433228 0.82 PKM (0.56) TACR1CTSLCTSSCTSKMAPT
SCHEMBL16463539 0.81 TACR1 (0.60) TACR1CTSLCTSSCTSKMAPT
SCHEMBL16463542 0.81 TACR1 (0.60) TACR1CTSLCTSSCTSKMAPT
SCHEMBL8553442 0.80 ACE (0.61) TACR1CTSLCTSSCTSKMAPT

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 5 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
US-20040186301-A1 Derivatives of succinic and glutaric acids and analogs thereof useful as inhibitors of phex BIOMEP INC. 2004-09-23 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 (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 TACR1 3920/4885CTSL 2006/4885REN 2431/4885
US-20040186301-A1 Derivatives of succinic and glutaric acids and analogs thereof useful as inhibitors of phex GLS, SUCNR1, PGD TACR1 3994/4885CTSL 2180/4885REN 2568/4885
US-20060135480-A1 Derivatives of succinic and glutaric acids and analogs thereof useful as inhibitors of phex GLS, SUCNR1, GCDH TACR1 4027/4885CTSL 2287/4885REN 2643/4885

“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.