SCHEMBL23914685

SCHEMBL23914685

CCOC(=O)c1cn(Cc2nc3cc(OCC4CC4)c(C(F)(F)F)cc3[nH]2)c2ccccc2c1=O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
S1PR2 O95136 5/20 0.54
TDP1 Q9NUW8 1/20 0.39
AR P10275 1/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.37
KDM4E B2RXH2 1/20 0.37
P2RX3 P56373 1/20 0.37
RBP4 P02753 5/20 0.36
TTR P02766 4/20 0.36
DGAT1 O75907 1/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
KMT2A Q03164 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
SCHEMBL23908922 0.90 S1PR2 (0.59) S1PR2LMNARBP4TTR
SCHEMBL23914687 0.89 S1PR2 (0.52) S1PR2TDP1HPGDP2RX3
SCHEMBL23966874 0.87 S1PR2 (0.52) S1PR2RBP4TTR
SCHEMBL23915325 0.86 S1PR2 (0.58) S1PR2RBP4TTR
SCHEMBL23908933 0.79 S1PR2 (0.58) S1PR2LMNA
SCHEMBL23909004 0.79 S1PR2 (0.63) S1PR2RBP4TTR
SCHEMBL23909123 0.78 S1PR2 (0.40) S1PR2TDP1ARLMNAKDM4E
SCHEMBL23908974 0.74 S1PR2 (0.56) S1PR2
SCHEMBL23915478 0.73 S1PR2 (0.63) S1PR2TDP1LMNAHPGDP2RX3
SCHEMBL23908800 0.70 S1PR2 (1.00) S1PR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3649119-B1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GALAPAGOS NV (BE) 2021-11-03 EP disclosed
US-20210315893-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GILEAD SCIENCES, INC. 2021-10-14 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-20210315893-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS S1PR1, S1PR3, S1PR2 S1PR2 3/4885TDP1 3466/4885AR 890/4885

“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.