SCHEMBL23915349

SCHEMBL23915349

CCOC(=O)c1cn(Cc2nc3cc(C#N)c(OCC(F)F)cc3n2COCCS(C)(C)C)c2ccccc2c1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.36
HTT P42858 1/20 0.36
AR P10275 1/20 0.36
P2RX3 P56373 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAPT P10636 2/20 0.33
PKM P14618 1/20 0.33
LMNA P02545 1/20 0.32
TSHR P16473 3/20 0.32
KMT2A Q03164 3/20 0.32
ALDH1A1 P00352 3/20 0.32
KDM4E B2RXH2 3/20 0.32
MEN1 O00255 2/20 0.32
GAA P10253 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
F2RL3 Q96RI0 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
SCHEMBL23915348 0.97 HSD17B10 (0.36) HSD17B10HTTARP2RX3TDP1
SCHEMBL23914625 0.92 HTT (0.36) HSD17B10HTTARP2RX3TDP1
SCHEMBL23909032 0.89 HTT (0.36) HSD17B10HTTARP2RX3TDP1
SCHEMBL23966537 0.89 HTT (0.36) HSD17B10HTTARP2RX3TDP1
SCHEMBL23966538 0.89 HTT (0.36) HSD17B10HTTARP2RX3TDP1
SCHEMBL23915583 0.78 S1PR2 (0.38) HSD17B10HTTF2RL3
SCHEMBL23909123 0.77 S1PR2 (0.40) HSD17B10HTTARP2RX3TDP1
SCHEMBL23915471 0.77 XDH (0.32)
SCHEMBL23915460 0.75
SCHEMBL23915472 0.73 XDH (0.32)

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-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 HSD17B10 2447/4885HTT 4536/4885AR 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.