SCHEMBL16081990

SCHEMBL16081990

CCNCC1(C(=O)O)CC1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.35
FFAR3 O14843 1/20 0.33
TP53 P04637 1/20 0.30

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
Trifluoroacetic Acid SCHEMBL16057457 0.89 SLC1A2 (0.31)
Hydrochloric Acid SCHEMBL5510959 0.88 CYP2C19 (0.48) CYP2C19
SCHEMBL24743654 0.80
SCHEMBL4146679 0.76
SCHEMBL30879561 0.74 CYP2C19 (0.58) CYP2C19
Hydrochloric Acid SCHEMBL17476050 0.74 CYP2C19 (0.37) CYP2C19FFAR3
SCHEMBL18756259 0.73
SCHEMBL4149507 0.73 ALDH1A1 (0.42) CYP2C19FFAR3
SCHEMBL20988000 0.72 CYP2C19 (0.32) CYP2C19FFAR3
SCHEMBL245571 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3998260-B1 SGC STIMULATORS CYCLERION THERAPEUTICS INC (US) 2023-11-01 EP disclosed
US-20230295076-A1 ACETOPHENONE OXIME COMPOUND AND APPLICATION THEREOF MEDSHINE DISCOVERY INC. (CN) 2023-09-21 US disclosed
US-20230159504-A1 7- OR 8-HYDROXY-ISOQUINOLINE AND 7- OR 8-HYDROXY-QUINOLINE DERIVATIVES AS ALPHA-1-ANTITRYPSIN MODULATORS FOR TREATING ALPHA-1-ANTITRYPSIN DEFICIENCY (AATD) VERTEX PHARMACEUTICALS INCORPORATED 2023-05-25 US disclosed
EP-3998260-A1 SGC STIMULATORS Cyclerion Therapeutics, Inc. (US) 2022-05-18 EP disclosed
US-11207323-B2 sGC stimulators CYCLERION THERAPEUTICS, INC. (US) 2021-12-28 US disclosed
US-20200316065-A1 sGC STIMULATORS CYCLERION THERAPEUTICS, INC. 2020-10-08 US disclosed
EP-3660013-A1 SGC STIMULATORS Cyclerion Therapeutics, Inc. (US) 2020-06-03 EP disclosed
US-10639308-B2 sGC stimulators CYCLERION THERAPEUTICS, INC. (US) 2020-05-05 US disclosed
US-20190167679-A1 sGC STIMULATORS CYCLERION THERAPEUTICS, INC. 2019-06-06 US disclosed
US-10183021-B2 sGC stimulators IRONWOOD PHARMACEUTICALS, INC. (US) 2019-01-22 US disclosed
US-9586937-B2 sGC stimulators IRONWOOD PHARMACEUTICALS, INC. (US) 2017-03-07 US disclosed
US-9586937-B2 sGC stimulators IRONWOOD PHARMACEUTICALS, INC. (US) 2017-03-07 US disclosed
US-20160375022-A1 sGC STIMULATORS IRONWOOD PHARMACEUTICALS, INC. (US) 2016-12-29 US disclosed
US-20160347738-A1 sGC STIMULATORS CYCLERION THERAPEUTICS, INC. 2016-12-01 US disclosed
US-20160347738-A1 sGC STIMULATORS CYCLERION THERAPEUTICS, INC. 2016-12-01 US disclosed
US-9481689-B2 sGC stimulators IRONWOOD PHARMACEUTICALS, INC. (US) 2016-11-01 US disclosed
US-9481689-B2 sGC stimulators IRONWOOD PHARMACEUTICALS, INC. (US) 2016-11-01 US disclosed
US-20160031903-A1 sGC STIMULATORS IRONWOOD PHARMACEUTICALS, INC. (US) 2016-02-04 US disclosed
US-20160031903-A1 sGC STIMULATORS IRONWOOD PHARMACEUTICALS, INC. (US) 2016-02-04 US disclosed
WO-2014144100-A2 SGC STIMULATORS NAKAI TAKASHI (US) 2014-09-18 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 (10 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-20230295076-A1 ACETOPHENONE OXIME COMPOUND AND APPLICATION THEREOF CYP11B2, ALDH7A1, CYP11B1 CYP2C19 80/4885FFAR3 2109/4885TP53 2996/4885
US-11207323-B2 sGC stimulators PTGIS, CGAS, GUCY1A1 CYP2C19 1024/4885FFAR3 2714/4885TP53 4691/4885
US-10639308-B2 sGC stimulators PTGIS, CGAS, GUCY1A1 CYP2C19 1024/4885FFAR3 2714/4885TP53 4691/4885
US-20160347738-A1 sGC STIMULATORS PTGIS, CGAS, GUCY1A1 CYP2C19 1024/4885FFAR3 2714/4885TP53 4691/4885
US-10183021-B2 sGC stimulators PTGIS, CGAS, GUCY1A1 CYP2C19 1024/4885FFAR3 2714/4885TP53 4691/4885
US-20160375022-A1 sGC STIMULATORS PTGIS, CGAS, GUCY1A1 CYP2C19 1024/4885FFAR3 2714/4885TP53 4691/4885
US-20230159504-A1 7- OR 8-HYDROXY-ISOQUINOLINE AND 7- OR 8-HYDROXY-QUINOLINE DERIVATIVES AS ALPHA-1-ANTITRYPSIN MODULATORS FOR TREATING ALPHA-1-ANTITRYPSIN DEFICIENCY (AATD) SERPINA2, SERPINB1, SERPINE1 CYP2C19 3029/4885FFAR3 4786/4885TP53 3964/4885
US-20190167679-A1 sGC STIMULATORS PTGIS, CGAS, GUCY1A1 CYP2C19 1024/4885FFAR3 2714/4885TP53 4691/4885
US-20160031903-A1 sGC STIMULATORS PTGIS, CGAS, GUCY1A1 CYP2C19 1024/4885FFAR3 2714/4885TP53 4691/4885
US-20200316065-A1 sGC STIMULATORS PTGIS, CGAS, GUCY1A1 CYP2C19 1024/4885FFAR3 2714/4885TP53 4691/4885

“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.