SCHEMBL7823764

SCHEMBL7823764

CCC(=O)c1ccccc1OCC(=O)O

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.64
GLA P06280 1/20 0.64
POLB P06746 2/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
KDM4E B2RXH2 4/20 0.53
ABCB1 P08183 5/20 0.52
ALDH1A1 P00352 2/20 0.51
PTGDR2 Q9Y5Y4 1/20 0.51
HTT P42858 1/20 0.51
HPGD P15428 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
RAB9A P51151 1/20 0.50
USP2 O75604 1/20 0.49
TSHR P16473 1/20 0.49
HSD17B10 Q99714 1/20 0.49
ALOX15 P16050 1/20 0.48

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
SCHEMBL14273065 0.84 L3MBTL1 (0.56) L3MBTL1GLAPOLBSMN1; SMN2KDM4E
SCHEMBL3029800 0.84 HCRTR1 (0.62) L3MBTL1GLAKDM4EABCB1ALDH1A1
SCHEMBL3618678 0.83 ALDH1A1 (0.56) SMN1; SMN2KDM4EABCB1ALDH1A1HTT
SCHEMBL16036357 0.83 L3MBTL1 (0.54) L3MBTL1GLAPOLBSMN1; SMN2KDM4E
SCHEMBL4006491 0.82 LMNA (0.64) L3MBTL1GLAPOLBSMN1; SMN2KDM4E
SCHEMBL18702668 0.82 ABCB1 (0.71) SMN1; SMN2ABCB1ALDH1A1HPGDRAB9A
SCHEMBL29502958 0.82 KDM4E (0.73) L3MBTL1GLAPOLBSMN1; SMN2KDM4E
SCHEMBL341639 0.82 KDM4E (0.73) L3MBTL1GLAPOLBSMN1; SMN2KDM4E
SCHEMBL8414408 0.82 L3MBTL1 (0.61) L3MBTL1GLAPOLBSMN1; SMN2KDM4E
SCHEMBL4431127 0.81 SGMS2 (0.59) L3MBTL1POLBSMN1; SMN2KDM4EABCB1

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
US-20220227739-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CFTR PROTEOSTASIS THERAPEUTICS INC (US) 2022-07-21 US disclosed
CN-108430994-B Compounds, compositions and methods for modulating CFTR 蛋白质平衡治疗股份有限公司 2022-04-12 CN disclosed
US-11136313-B2 Compounds, compositions, and methods for modulating CFTR PROTEOSTASIS THERAPEUTICS, INC. (US) 2021-10-05 US disclosed
EP-3359536-B1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CFTR PROTEOSTASIS THERAPEUTICS INC (US) 2021-08-04 EP disclosed
US-20200385365-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CFTR PROTEOSTASIS THERAPEUTICS, INC. 2020-12-10 US disclosed
US-10550106-B2 Compounds, compositions, and methods for modulating CFTR PROTEOSTASIS THERAPEUTICS, INC. (US) 2020-02-04 US disclosed
US-20180291006-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CFTR PROTEOSTASIS THERAPEUTICS, INC. 2018-10-11 US disclosed
WO-2017062581-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CFTR PROTEOSTASIS THERAPEUTICS, INC. (US) 2017-04-13 WO disclosed
CN-1314906-A Salts of paroxetine SMITHKLINE BEECHAM PLC (GB) 2001-09-26 CN disclosed
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 WO disclosed
US-4207234-A 4-Unsubstituted azetidinone derivatives and process for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-06-10 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 (5 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-11136313-B2 Compounds, compositions, and methods for modulating CFTR CFTR, SCNN1B, SCNN1G L3MBTL1 3020/4885GLA 3259/4885POLB 1071/4885
US-20200385365-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CFTR CFTR, SCNN1B, SCNN1G L3MBTL1 3020/4885GLA 3259/4885POLB 1071/4885
US-20220227739-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CFTR CFTR, SCNN1B, SCNN1G L3MBTL1 3020/4885GLA 3259/4885POLB 1071/4885
US-10550106-B2 Compounds, compositions, and methods for modulating CFTR CFTR, SCNN1B, SCNN1G L3MBTL1 3020/4885GLA 3259/4885POLB 1071/4885
US-20180291006-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CFTR CFTR, SCNN1B, SCNN1G L3MBTL1 3020/4885GLA 3259/4885POLB 1071/4885

“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.