SCHEMBL24258739

SCHEMBL24258739

Cc1cc(CCCCCO)ccn1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BCHE P06276 5/20 0.41
UHRF1 Q96T88 1/20 0.41
CYP4F2 P78329 3/20 0.40
CYP4A11 Q02928 3/20 0.40
KCNQ2 O43526 1/20 0.38
CA2 P00918 1/20 0.38
ACHE P22303 2/20 0.37
GSK3A P49840 2/20 0.37
GSK3B P49841 2/20 0.37
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
P2RY12 Q9H244 1/20 0.37
FFAR1 O14842 1/20 0.36
IGF1R P08069 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL4282403 0.93 UHRF1 (0.43) UHRF1CYP4F2CYP4A11KCNQ2CA2
SCHEMBL2023682 0.85 UHRF1 (0.46) UHRF1CYP4F2CYP4A11KCNQ2CA2
SCHEMBL30324476 0.85 UHRF1 (0.46) UHRF1CYP4F2CYP4A11KCNQ2CA2
SCHEMBL4358691 0.85 UHRF1 (0.50) UHRF1KCNQ2GSK3AGSK3BFFAR1
SCHEMBL21524074 0.84 TDP1 (0.44) UHRF1ACHE
SCHEMBL28131466 0.84 TDP1 (0.44) UHRF1ACHE
SCHEMBL4355540 0.80 UHRF1 (0.54) UHRF1KCNQ2GSK3AGSK3BFFAR1
SCHEMBL5573904 0.80 CCR1 (0.53) BCHEUHRF1CYP4F2CYP4A11ACHE
SCHEMBL22526071 0.80 FFAR1 (0.42) KCNQ2GSK3AGSK3BFFAR1
SCHEMBL9402852 0.79 SKP2 (0.47) UHRF1KCNQ2GSK3AGSK3BALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11713312-B2 Substituted bicyclic compounds as farnesoid X receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2023-08-01 US disclosed
US-20220135550-A1 SUBSTITUTED BICYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS BRISTOL MYERS SQUIBB CO (US) 2022-05-05 US disclosed
US-11254663-B2 Substituted bicyclic compounds as farnesoid X receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2022-02-22 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 (3 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-20220135550-A1 SUBSTITUTED BICYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS FXR1, NR1H4, FXR2 BCHE 2874/4885UHRF1 4365/4885CYP4F2 150/4885
US-11254663-B2 Substituted bicyclic compounds as farnesoid X receptor modulators FXR1, NR1H4, FXR2 BCHE 2874/4885UHRF1 4365/4885CYP4F2 150/4885
US-11713312-B2 Substituted bicyclic compounds as farnesoid X receptor modulators FXR1, NR1H4, FXR2 BCHE 2874/4885UHRF1 4365/4885CYP4F2 150/4885

“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.