SCHEMBL7327464

SCHEMBL7327464

CCCCN1CCC(CC(=O)O)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.47
EPHX2 P34913 2/20 0.47
KCNH2 Q12809 2/20 0.46
GNAO1 P09471 4/20 0.44
GNAI3 P08754 3/20 0.44
GNAI1 P63096 3/20 0.44
CHRM1 P11229 2/20 0.43
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
HTR1A P08908 1/20 0.43
CHRM5 P08912 1/20 0.43
ADRA2A P08913 1/20 0.43
DRD2 P14416 1/20 0.43
ADRA2B P18089 1/20 0.43
CHRM3 P20309 1/20 0.43
DRD4 P21917 1/20 0.43
ADRA1D P25100 1/20 0.43
ADRA1A P35348 1/20 0.43
HRH1 P35367 1/20 0.43
ADRA1B P35368 1/20 0.43

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
Hydrochloric Acid SCHEMBL23533426 0.98 GNAO1 (0.47) EPHX1EPHX2KCNH2GNAO1GNAI3
SCHEMBL23533551 0.95 KCNH2 (0.51) EPHX1EPHX2KCNH2GNAO1GNAI3
Hydrochloric Acid SCHEMBL29966132 0.93 GNAO1 (0.53) KCNH2GNAO1GNAI3GNAI1CHRM1
SCHEMBL13934478 0.89 SMN1; SMN2 (0.46) EPHX1EPHX2KCNH2GNAO1GNAI3
SCHEMBL25133751 0.84 CYP1A2 (0.40) CHRM1CHRM2CHRM4CHRM5DRD2
Acetic Acid SCHEMBL30329912 0.82 EPHX1 (0.47) EPHX1EPHX2KCNH2GNAO1GNAI3
SCHEMBL12442951 0.82 KCNH2 (0.45) EPHX1EPHX2KCNH2GNAO1GNAI3
SCHEMBL13472647 0.81 EPHX1 (0.47) EPHX1EPHX2GNAO1GNAI3GNAI1
SCHEMBL1762876 0.81 SMN1; SMN2 (0.52) EPHX1EPHX2
SCHEMBL8971215 0.81 GNAO1 (0.50) EPHX1EPHX2KCNH2GNAO1GNAI3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230107538-A1 CYCLOALKYL-CONTAINING CARBOXYLIC ACIDS AND USES THEREOF Liminal Biosciences Limited (GB) 2023-04-06 US disclosed
US-20230107538-A1 CYCLOALKYL-CONTAINING CARBOXYLIC ACIDS AND USES THEREOF Liminal Biosciences Limited (GB) 2023-04-06 US disclosed
EP-4076649-A1 CYCLOALKYL-CONTAINING CARBOXYLIC ACIDS AND USES THEREOF Liminal Biosciences Limited (GB) 2022-10-26 EP disclosed
CN-114828958-A Cycloalkyl-containing carboxylic acids and use thereof 里米诺生物科学有限公司 2022-07-29 CN disclosed
WO-2021124272-A1 CYCLOALKYL-CONTAINING CARBOXYLIC ACIDS AND USES THEREOF Liminal Biosciences Limited (GB) 2021-06-24 WO disclosed
EP-2840083-B1 NITROGENATED BICYCLIC AROMATIC HETEROCYCLIC COMPOUND ASTELLAS PHARMA INC (JP) 2017-09-13 EP disclosed
US-20070149538-A1 Diarylamine-Containing Compounds and Compositions, and their use as Modulators of C-Kit Receptors IRM LLC (BM) 2007-06-28 US disclosed
EP-0684947-A1 AMIDE COMPOUNDS WITH PHARMACOLOGICAL ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1995-12-06 EP disclosed
WO-1994019344-A1 AMIDE COMPOUNDS WITH PHARMACOLOGICAL ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1994-09-01 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 (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-20070149538-A1 Diarylamine-Containing Compounds and Compositions, and their use as Modulators of C-Kit Receptors KIT, PRKCH, PRKCE EPHX1 1817/4885EPHX2 2063/4885KCNH2 837/4885
US-20230107538-A1 CYCLOALKYL-CONTAINING CARBOXYLIC ACIDS AND USES THEREOF HCCS, CCL11, BCAT1 EPHX1 2180/4885EPHX2 2009/4885KCNH2 3330/4885

“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.