SCHEMBL23375162

SCHEMBL23375162

CCCCC1(CCCC)CN(c2ccccc2)c2cc(Cl)c(OCC(=O)OC)cc2S(O)(O)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
NR1H4 Q96RI1 1/20 0.37
SLC10A2 Q12908 2/20 0.34
PSEN1 P49768 2/20 0.34
PSEN2 P49810 2/20 0.34
APH1B Q8WW43 2/20 0.34
NCSTN Q92542 2/20 0.34
APH1A Q96BI3 2/20 0.34
PSENEN Q9NZ42 2/20 0.34
ALDH1A1 P00352 4/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
FAAH O00519 1/20 0.34
OPRM1 P35372 1/20 0.34
OPRL1 P41146 1/20 0.34
KDM4E B2RXH2 2/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
MDM4 O15151 1/20 0.33
MDM2 Q00987 1/20 0.33

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
SCHEMBL23375121 0.92 SLC10A2 (0.39) LMNANR1H4SLC10A2PSEN1PSEN2
SCHEMBL23375161 0.92 SLC10A2 (0.39) LMNANR1H4SLC10A2PSEN1PSEN2
SCHEMBL23375164 0.90 NR1H4 (0.37) NR1H4SLC10A2PSEN1PSEN2APH1B
SCHEMBL23375157 0.88 OPRM1 (0.38) NR1H4SLC10A2PSEN1PSEN2APH1B
SCHEMBL22286522 0.87 SLC10A2 (0.39) LMNANR1H4SLC10A2KMT2AMEN1
SCHEMBL22286419 0.86 FAAH (0.35) LMNANR1H4SLC10A2ALDH1A1L3MBTL1
SCHEMBL23375104 0.85 OPRM1 (0.37) NR1H4SLC10A2PSEN1PSEN2APH1B
SCHEMBL22286359 0.84 SLC10A2 (0.40) LMNANR1H4SLC10A2KMT2AMEN1
SCHEMBL23375120 0.83 SLC10A2 (0.44) LMNANR1H4SLC10A2TDP1MAPK1
SCHEMBL23375167 0.83 SLC10A2 (0.48) NR1H4SLC10A2ALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12024495-B2 Benzothiazepine compounds and their use as bile acid modulators ALBIREO AB (SE) 2024-07-02 US disclosed
US-20210299141-A1 BENZOTHIAZEPINE COMPOUNDS AND THEIR USE AS BILE ACID MODULATORS ALBIREO AB (SE) 2021-09-30 US disclosed
US-20210171479-A1 BENZOTHIAZEPINE COMPOUNDS AND THEIR USE AS BILE ACID MODULATORS ALBIREO AB (SE) 2021-06-10 US disclosed
WO-2021110887-A1 BENZOTHIAZEPINE COMPOUNDS AND THEIR USE AS BILE ACID MODULATORS ALBIREO AB (SE) 2021-06-10 WO disclosed
US-11014898-B1 Benzothiazepine compounds and their use as bile acid modulators ALBIREO AB (SE) 2021-05-25 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 (4 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-12024495-B2 Benzothiazepine compounds and their use as bile acid modulators SLC10A1, SLC10A2, ABCB11 LMNA 2925/4885NR1H4 6/4885SLC10A2 2/4885
US-20210171479-A1 BENZOTHIAZEPINE COMPOUNDS AND THEIR USE AS BILE ACID MODULATORS SLC10A1, SLC10A2, ABCB11 LMNA 3098/4885NR1H4 6/4885SLC10A2 2/4885
US-20210299141-A1 BENZOTHIAZEPINE COMPOUNDS AND THEIR USE AS BILE ACID MODULATORS SLC10A1, SLC10A2, ABCB11 LMNA 2925/4885NR1H4 6/4885SLC10A2 2/4885
US-11014898-B1 Benzothiazepine compounds and their use as bile acid modulators SLC10A1, SLC10A2, ABCB11 LMNA 2925/4885NR1H4 6/4885SLC10A2 2/4885

“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.