SCHEMBL241599

SCHEMBL241599

Cc1ccccc1OC(=O)CC(=O)Oc1ccccc1C

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.58
ATM Q13315 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
NOTUM Q6P988 1/20 0.49
NPSR1 Q6W5P4 1/20 0.47
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
PPARG P37231 1/20 0.46
BCHE P06276 1/20 0.46
KDM4E B2RXH2 1/20 0.46
CYP1A2 P05177 1/20 0.46

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
SCHEMBL31412759 0.91 TDP1 (0.51) TDP1ATML3MBTL1NOTUMNPSR1
SCHEMBL4825104 0.91 ALDH1A1 (0.53) TDP1ATML3MBTL1KDM4E
SCHEMBL241600 0.90 TDP1 (0.54) TDP1ATML3MBTL1NOTUMNPSR1
SCHEMBL10907508 0.90 TDP1 (0.54) TDP1ATML3MBTL1NOTUMNPSR1
SCHEMBL29941922 0.88 TDP1 (0.58) TDP1ATML3MBTL1NOTUMMEN1
SCHEMBL644115 0.88 TDP1 (0.58) TDP1ATML3MBTL1NOTUMMEN1
SCHEMBL5404741 0.86 TDP1 (0.57) TDP1ATML3MBTL1LMNAKMT2A
SCHEMBL27800887 0.86 TDP1 (0.61) TDP1ATML3MBTL1NOTUMSMN1; SMN2
SCHEMBL2097797 0.86 TDP1 (0.50) TDP1ATML3MBTL1NOTUMNPSR1
SCHEMBL15763991 0.85 MEN1 (0.51) TDP1ATML3MBTL1NOTUMNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110914334-A Polyester copolymer 阿凡田知识中心有限公司 2020-03-24 CN disclosed
US-8859803-B2 Process for production of ketomalonic acid compounds or hydrates thereof IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2014-10-14 US disclosed
EP-2447243-A1 PROCESS FOR PRODUCTION OF KETOMALONIC ACID COMPOUNDS OR HYDRATES THEREOF Ihara Chemical Industry Co., Ltd. (JP) 2012-05-02 EP disclosed
US-20120004443-A1 PROCESS FOR PRODUCTION OF KETOMALONIC ACID COMPOUNDS OR HYDRATES THEREOF IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2012-01-05 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-20120004443-A1 PROCESS FOR PRODUCTION OF KETOMALONIC ACID COMPOUNDS OR HYDRATES THEREOF ME1, CA6, ME3 TDP1 4627/4885ATM 1905/4885L3MBTL1 639/4885

“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.