SCHEMBL24259285

SCHEMBL24259285

C=C(F)CCC(=O)N(CCOCCc1nc(C(C)(C)C)no1)c1cccc(Br)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
TP53 P04637 1/20 0.33
NR1H4 Q96RI1 10/20 0.32
NFKB1 P19838 1/20 0.32
PSMB5 P28074 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
CNR2 P34972 1/20 0.32
LMNA P02545 1/20 0.31
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
RXRG P48443 1/20 0.31
NR1I2 O75469 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL24259219 0.80 MAPT (0.36) MAPT
SCHEMBL24259435 0.77 HDAC2 (0.32) MAPTNR1H4CNR2
SCHEMBL24258994 0.76 PAX8 (0.36) MAPTTP53LMNARXRARXRB
SCHEMBL24259316 0.75 MAPT (0.36) MAPTNR1H4LMNANR1I2CYP2C9
SCHEMBL24258960 0.75 NR1H4 (0.49) MAPTTP53NR1H4
SCHEMBL24259347 0.75 MAPT (0.37) MAPTTP53NR1H4LMNA
SCHEMBL24258927 0.75 MAPT (0.34) MAPTTP53NR1H4LMNANR1I2
SCHEMBL24259475 0.74 NR1H4 (0.44) MAPTNR1H4NR1I2CYP2C9CYP2C19
SCHEMBL22354110 0.74 MAPT (0.36) MAPTTP53NR1H4LMNA
SCHEMBL24258760 0.72 AKR1C4 (0.36) MAPTNR1H4NR1I2CYP2C9CYP2C19

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 398/4885TP53 1398/4885NR1H4 2/4885
US-11254663-B2 Substituted bicyclic compounds as farnesoid X receptor modulators FXR1, NR1H4, FXR2 MAPT 398/4885TP53 1398/4885NR1H4 2/4885
US-11713312-B2 Substituted bicyclic compounds as farnesoid X receptor modulators FXR1, NR1H4, FXR2 MAPT 398/4885TP53 1398/4885NR1H4 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.