SCHEMBL22356644

SCHEMBL22356644

CC(C)(C)OC(=O)Nc1ccccc1-c1cc(NC(=O)C(F)(F)F)n[nH]1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.43
NPY5R Q15761 2/20 0.40
TNIK Q9UKE5 1/20 0.40
FGFR4 P22455 1/20 0.40
TRPV1 Q8NER1 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
KDR P35968 2/20 0.39
RET P07949 1/20 0.39
BRD9 Q9H8M2 1/20 0.38
PARP14 Q460N5 1/20 0.38
IDO1 P14902 1/20 0.38
METAP1 P53582 1/20 0.37
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
HSP90AA1 P07900 1/20 0.37
HSP90AB1 P08238 1/20 0.37

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
SCHEMBL22356641 0.77 ADORA3 (0.46) NPY5RTNIKIDO1RAB9ANPC1
SCHEMBL18704308 0.75 KMT2A (0.49) RXFP1TRPV1LMNAPOLBBRD9
SCHEMBL22356726 0.75 FGFR4 (0.73) NPY5RFGFR4LMNAHSP90AA1HSP90AB1
SCHEMBL1502279 0.74 IDO1 (0.45) RXFP1TRPV1LMNAPOLBBRD9
SCHEMBL18535719 0.69 BRD9 (0.50) RXFP1TRPV1LMNAPOLBBRD9
SCHEMBL2880191 0.69 LMNA (0.54) RXFP1LMNAPOLBBRD9METAP1
SCHEMBL28444082 0.69 CHRM3 (0.52) LMNABRD9
SCHEMBL22356643 0.69 NPY5R (0.41) NPY5RTNIKKDRRETRAB9A
SCHEMBL4414634 0.68 LMNA (0.48) RXFP1TRPV1LMNAPOLBBRD9
SCHEMBL2940952 0.67 GAA (0.51) RXFP1LMNAPOLBBRD9METAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200262827-A1 AROMATIC DERIVATIVE, PREPARATION METHOD FOR SAME, AND MEDICAL APPLICATIONS THEREOF BIOARDIS LLC (US) 2020-08-20 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 (1 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-20200262827-A1 AROMATIC DERIVATIVE, PREPARATION METHOD FOR SAME, AND MEDICAL APPLICATIONS THEREOF FGFR4, FGFR1, FGFR3 RXFP1 627/4885NPY5R 1264/4885TNIK 1865/4885

“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.