SCHEMBL24259504

SCHEMBL24259504

C=C(CCF)C(=O)N(CCCCCc1nc(C(F)F)no1)c1cccc(Br)c1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
HDAC1 Q13547 7/20 0.31
HDAC2 Q92769 7/20 0.31
HDAC8 Q9BY41 6/20 0.31
ALOX15 P16050 2/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
TSHR P16473 1/20 0.30
NR1H4 Q96RI1 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
SCHEMBL22354110 0.86 MAPT (0.36) MAPTHDAC1HDAC2HDAC8ALOX15
SCHEMBL24259316 0.85 MAPT (0.36) MAPTHDAC1HDAC2HDAC8ALOX15
SCHEMBL24259017 0.85 AKR1C4 (0.35) MAPTNR1H4
SCHEMBL24259347 0.78 MAPT (0.37) MAPTHDAC1HDAC2HDAC8ALOX15
SCHEMBL24602563 0.78 POLB (0.31) MAPTALDH1A1
SCHEMBL24259515 0.78 HDAC1 (0.33) MAPTHDAC1HDAC8NR1H4
SCHEMBL22353640 0.77 NR1H4 (0.35) NR1H4
SCHEMBL24259367 0.77 ALDH1A1 (0.35) MAPTALDH1A1LMNA
SCHEMBL24602602 0.77 LMNA (0.41) MAPTHDAC1HDAC2HDAC8ALDH1A1
SCHEMBL24259062 0.77 ALDH1A1 (0.35) ALDH1A1LMNAHTTNR1H4

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 MAPT 398/4885HDAC1 998/4885HDAC2 1068/4885
US-11254663-B2 Substituted bicyclic compounds as farnesoid X receptor modulators FXR1, NR1H4, FXR2 MAPT 398/4885HDAC1 998/4885HDAC2 1068/4885
US-11713312-B2 Substituted bicyclic compounds as farnesoid X receptor modulators FXR1, NR1H4, FXR2 MAPT 398/4885HDAC1 998/4885HDAC2 1068/4885

“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.