SCHEMBL716987

SCHEMBL716987

NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MME P08473 1/20 0.65
ECE1 P42892 1/20 0.65
FOLH1 Q04609 2/20 0.57
SMN1; SMN2 Q16637 1/20 0.56
PPARG P37231 1/20 0.55
PPARA Q07869 1/20 0.55
KMT2A Q03164 1/20 0.54
CTSK P43235 2/20 0.54
SIRT2 Q8IXJ6 1/20 0.54
SIRT1 Q96EB6 1/20 0.54

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
SCHEMBL10192704 1.00 MME (0.65) MMEECE1FOLH1SMN1; SMN2PPARG
SCHEMBL716988 1.00 MME (0.65) MMEECE1FOLH1SMN1; SMN2PPARG
SCHEMBL3509748 1.00 MME (0.65) MMEECE1FOLH1SMN1; SMN2PPARG
SCHEMBL11251557 0.99 MME (0.64) MMEECE1FOLH1SMN1; SMN2PPARG
Glycine SCHEMBL27457065 0.95 MME (0.60) MMEECE1FOLH1SMN1; SMN2PPARG
Glycine SCHEMBL7140457 0.95 MME (0.60) MMEECE1FOLH1SMN1; SMN2PPARG
SCHEMBL11153005 0.92 CTSL (0.61) MMEECE1SMN1; SMN2CTSKSIRT2
SCHEMBL28993693 0.92 MME (0.56) MMEECE1SMN1; SMN2CTSK
SCHEMBL4919347 0.92 MME (0.56) MMEECE1SMN1; SMN2CTSK
SCHEMBL29682481 0.92 MME (0.56) MMEECE1SMN1; SMN2CTSK

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 314 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118581600-A Polyrotaxane/graphene oxide composite fiber and preparation method thereof 东华大学 2024-09-03 CN claimed
CN-114736159-B Photo-crosslinking molecular probe and preparation method and application thereof 南京医科大学 2024-05-07 CN claimed
CN-115068666-B Anti-adhesion hemostatic hydrogel and preparation method and application thereof 广东粤港澳大湾区国家纳米科技创新研究院 2023-12-26 CN claimed
CN-116615257-A Selenium antibody conjugates 瑞泽恩制药公司 2023-08-18 CN claimed
CN-115068666-A Anti-adhesion hemostatic hydrogel and preparation method and application thereof 广东粤港澳大湾区国家纳米科技创新研究院 2022-09-20 CN claimed
CN-114736159-A Photo-crosslinking molecular probe and preparation method and application thereof 南京医科大学 2022-07-12 CN claimed
US-20220143194-A1 SELENIUM ANTIBODY CONJUGATES REGENERON PHARMACEUTICALS, INC. 2022-05-12 US claimed
EP-3988538-A1 MODIFIED HYDROPHOBIC AUXILIARY MATERIAL, PREPARATION METHOD THEREFOR AND USE THEREOF Zhejiang Zhida Pharmaceutical Co., Ltd. (CN) 2022-04-27 EP claimed
US-20220111055-A1 MODIFIED HYDROPHOBIC EXCIPIENT AND PREPARATION METHOD THEREOF ZHEJIANG ZHIDA PHARMACEUTICAL CO., LTD. (CN) 2022-04-14 US claimed
WO-2020252713-A1 MODIFIED HYDROPHOBIC AUXILIARY MATERIAL, PREPARATION METHOD THEREFOR AND USE THEREOF 浙江智达药业有限公司 2020-12-24 WO claimed
EP-0815833-B1 Malodour preventing agents GIVAUDAN SA (CH) 2003-04-09 EP claimed
US-5925339-A ODORLESS DEODORANTS AND ANTIPERSPIRANTS GIVAUDAN ROURE SA (CH) 1999-07-20 US claimed
US-5757408-A PRINTING IMAGE ON SUBSTRATE COATED WITH AMINO-ACID DERIVATIVE ADDITIVE; QUICK DRYING OF INK, OPTICAL DENSITY, NONCURLING XEROX CORPORATION (US) 1998-05-26 US claimed
EP-0815833-A2 Malodour preventing agents GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1998-01-07 EP claimed
US-5683793-A Ink jet transparencies XEROX CORPORATION (US) 1997-11-04 US claimed
EP-0555046-B1 Method for determination of calcium ORIENTAL YEAST CO LTD (JP) 1997-07-30 EP claimed
US-5618684-A CALCIUM ACTIVATED TRANSGLUTAMINASE ACTS ON SUBSTRATE TO GENERATE AMMONIA; CORRELATING AMOUNT OF AMMONIA GENERATED WITH AN AMOUNT OF CALCIUM ORIENTAL YEAST CO., LTD. (JP) 1997-04-08 US claimed
US-5589277-A INK JET PRINTING, AQUEOUS INKS, FAST DRYING XEROX CORPORATION (US) 1996-12-31 US claimed
EP-0667246-A1 Recording sheets containing amino acids, hydroxy acids, and polycarboxyl compounds XEROX CORPORATION (US) 1995-08-16 EP claimed
EP-0281283-B1 HETEROCYCLIC COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-02-10 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20220143194-A1 SELENIUM ANTIBODY CONJUGATES SCLY, SELENOI, GPX1 MME 1420/4885ECE1 1323/4885FOLH1 118/4885
US-20220111055-A1 MODIFIED HYDROPHOBIC EXCIPIENT AND PREPARATION METHOD THEREOF CETP, SLC43A1, SLC27A1 MME 737/4885ECE1 834/4885FOLH1 3754/4885

“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.