SCHEMBL6895565

SCHEMBL6895565

COc1ccccc1C(=O)OCCl

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
HTT P42858 2/20 0.58
KMT2A Q03164 2/20 0.58
NPC1 O15118 2/20 0.57
RAB9A P51151 2/20 0.57
CTSD P07339 1/20 0.56
ATM Q13315 1/20 0.54
HPGD P15428 4/20 0.53
SMN1; SMN2 Q16637 1/20 0.51
GAA P10253 2/20 0.51
LMNA P02545 1/20 0.51
TSHR P16473 2/20 0.50
ESR1 P03372 1/20 0.50
ESR2 Q92731 1/20 0.50
XBP1 P17861 1/20 0.50
MAPT P10636 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
KDM4E B2RXH2 1/20 0.49

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
SCHEMBL29678391 0.85 TSHR (0.71) ALDH1A1L3MBTL1HTTKMT2ANPC1
SCHEMBL873499 0.85 TSHR (0.71) ALDH1A1L3MBTL1HTTKMT2ANPC1
SCHEMBL27986491 0.84 TSHR (0.61) ALDH1A1L3MBTL1NPC1SMN1; SMN2LMNA
SCHEMBL7954423 0.84 ALDH1A1 (0.56) ALDH1A1L3MBTL1HTTKMT2ANPC1
SCHEMBL514315 0.84 ALDH1A1 (0.56) ALDH1A1L3MBTL1HTTKMT2ANPC1
SCHEMBL2352850 0.83 HTT (0.50) ALDH1A1HTTKMT2ANPC1SMN1; SMN2
SCHEMBL10499171 0.83 TSHR (0.57) ALDH1A1L3MBTL1KMT2AATMLMNA
SCHEMBL12715452 0.82 ALDH1A1 (0.63) ALDH1A1L3MBTL1HTTKMT2ANPC1
SCHEMBL16178026 0.82 ALDH1A1 (0.65) ALDH1A1L3MBTL1HTTKMT2ANPC1
SCHEMBL2612556 0.82 ALDH1A1 (0.55) ALDH1A1L3MBTL1HTTKMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2822938-B1 RODENTICIDAL NORBORMIDE ANALOGUES LANDCARE RES NEW ZEALAND LIMITED (NZ) 2019-07-03 EP disclosed
CN-106588644-B A kind of synthetic method of carboxylic acid ester compound 杭州师范大学 2019-03-29 CN disclosed
CN-106588644-A Synthesis method of carboxylic ester compound 杭州师范大学 2017-04-26 CN disclosed
US-9198420-B2 Rodenticidal norbormide analogues LANDCARE RESEARCH NEW ZEALAND LIMITED (NZ) 2015-12-01 US disclosed
US-20150025113-A1 RODENTICIDAL NORBORMIDE ANALOGUES ANIMAL CONTROL PRODUCTS LIMITED (NZ) 2015-01-22 US disclosed
EP-2822938-A1 RODENTICIDAL NORBORMIDE ANALOGUES Landcare Research New Zealand Limited (NZ) 2015-01-14 EP disclosed
WO-2013133726-A1 RODENTICIDAL NORBORMIDE ANALOGUES LANDCARE RESEARCH NEW ZEALAND LIMITED (NZ) 2013-09-12 WO disclosed
US-6677331-B2 HAVING SUBSTITUTED IMIDAZO(5,1-B)THIAZOLE GROUP AT 2-POSITION; MICROBIOCIDES AGAINST BETA-LACTAMASE PRODUCING BACTERIA AND RESISTANT PSEUDOMONAS MEIJI SEIKA KAISHA, LTD. (JP) 2004-01-13 US disclosed
US-20030149016-A1 Novel carbapenem derivatives KANO YUKO (JP) 2003-08-07 US disclosed
US-6458780-B1 IMIDAZO(5,1-B)THIAZOLE GROUP AT THE 2-POSITION ON THE CARBAPENEM RING HAVE HIGH ANTI-MICROBIAL ACTIVITIES AGAINST .BETA.-LACTAMASE PRODUCING BACTERIA, MRSA, RESISTANT-PSEUDOMONAS AERUGINOSA, PRSP, ENTEROCOCCI, AND MEIJI SEIKA KAISHA, LTD. (JP) 2002-10-01 US disclosed
EP-1101766-A1 NOVEL CARBAPENEM DERIVATIVES MEIJI SEIKA KAISHA LTD. (JP) 2001-05-23 EP disclosed
US-4835312-A Production process of N-substituted amide compounds MITSUI CHEMICALS, INCORPORATED (JP) 1989-05-30 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 (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-20150025113-A1 RODENTICIDAL NORBORMIDE ANALOGUES CASP7, RANBP1, CASP3 ALDH1A1 1772/4885L3MBTL1 1112/4885HTT 3920/4885
US-20030149016-A1 Novel carbapenem derivatives DPEP1, TMPRSS15, STK35 ALDH1A1 1161/4885L3MBTL1 2671/4885HTT 3821/4885

“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.