SCHEMBL8895922

SCHEMBL8895922

CCN1C[C@H](O)C[C@H]1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.53
CD274 Q9NZQ7 4/20 0.35
PDCD1 Q15116 2/20 0.35
MME P08473 1/20 0.33
RIPK1 Q13546 1/20 0.33
GAA P10253 2/20 0.32

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
SCHEMBL21290883 1.00 ATM (0.53) ATMCD274PDCD1MMERIPK1
SCHEMBL5067978 1.00 ATM (0.53) ATMCD274PDCD1MMERIPK1
SCHEMBL12155273 0.85 ATM (0.50) ATMCD274PDCD1GAA
SCHEMBL8894208 0.85 ATM (0.50) ATMCD274PDCD1GAA
SCHEMBL14355763 0.85 ATM (0.50) ATMCD274PDCD1GAA
SCHEMBL12191622 0.85 ATM (0.50) ATMCD274PDCD1GAA
SCHEMBL26999793 0.84 ATM (0.40) ATMCD274GAA
SCHEMBL21618694 0.84 ATM (0.40) ATMCD274GAA
SCHEMBL20158970 0.82 MAOA (0.40) ATMGAA
SCHEMBL9965183 0.82 ATM (0.39) ATMGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5665371-A SIDE EFFECT REDUCTION HOERRMANN WILHELM (DE) 1997-09-09 US claimed
US-20180201838-A1 FLAME-RETARDANT POLYOLEFIN SYSTEMS BASF SE (DE) 2018-07-19 US disclosed
US-8871778-B2 Substituted pyrimidine compounds and their use as SYK inhibitors GENOSCO (US) 2014-10-28 US disclosed
US-20130274242-A1 SUBSTITUTED PYRIMIDINE COMPOUNDS AND THEIR USE AS SYK INHIBITORS Genosco Inc. 2013-10-17 US disclosed
WO-2013109882-A1 SUBSTITUTED PYRIMIDINE COMPOUNDS AND THEIR USE AS SYK INHIBITORS GENOSCO (US) 2013-07-25 WO disclosed
US-8389508-B2 Heterocyclic compounds GLAXO GROUP LIMITED (GB) 2013-03-05 US disclosed
US-20120077711-A1 Novel Ligands and Libraries of Ligands SUNESIS PHARMACEUTICALS, INC. (US) 2012-03-29 US disclosed
US-20110269738-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2011-11-03 US disclosed
WO-2010100142-A1 OXAZOLE PYRIDINE DERIVATIVES USEFUL AS S1P1 RECEPTOR AGONISTS MERCK SERONO S.A. (CH) 2010-09-10 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-20110269738-A1 COMPOUNDS CYP11B2, CYP11B1, GPR119 ATM 4555/4885CD274 4827/4885PDCD1 4739/4885
US-20130274242-A1 SUBSTITUTED PYRIMIDINE COMPOUNDS AND THEIR USE AS SYK INHIBITORS SYK, BTK, LCK ATM 220/4885CD274 2033/4885PDCD1 1547/4885
US-20120077711-A1 Novel Ligands and Libraries of Ligands LSS, ABCG2, SELL ATM 4042/4885CD274 707/4885PDCD1 3813/4885

“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.