SCHEMBL31339028

SCHEMBL31339028

FC(F)(F)c1ccc(OCc2ccccc2)c(Br)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.42
HTR2C P28335 1/20 0.40
SLC6A4 P31645 1/20 0.40
HTR2B P41595 1/20 0.40
MAPT P10636 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
PTGER1 P34995 1/20 0.40
MAPK1 P28482 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
RXRG P48443 1/20 0.40
MAPK14 Q16539 2/20 0.40
LTA4H P09960 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
STAT3 P40763 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 2/20 0.39
BRD4 O60885 1/20 0.39
NPC1 O15118 1/20 0.38

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
SCHEMBL26618377 1.00 SYK (0.42) SYKHTR2CSLC6A4HTR2BMAPT
SCHEMBL24975372 0.83 HTR2C (0.41) SYKHTR2CSLC6A4HTR2BMAPT
SCHEMBL22851668 0.82 MRGPRX4 (0.43) SYKHTR2CSLC6A4HTR2BMAPT
SCHEMBL24975462 0.82 SMN1; SMN2 (0.52) SYKHTR2CSLC6A4HTR2BMAPT
SCHEMBL26618637 0.78 NPC1 (0.39) SYKHTR2CSLC6A4HTR2BMAPT
SCHEMBL31339058 0.78 NPC1 (0.39) SYKHTR2CSLC6A4HTR2BMAPT
SCHEMBL26618448 0.78 NPC1 (0.48) SYKHTR2CSLC6A4HTR2BMAPT
SCHEMBL31339021 0.78 NPC1 (0.48) SYKHTR2CSLC6A4HTR2BMAPT
SCHEMBL2435879 0.78 L3MBTL1 (0.44) SLC6A4MAPTL3MBTL1MAPK1TDP1
SCHEMBL24976600 0.77 SLC6A4 (0.43) SYKHTR2CSLC6A4HTR2BMAPT

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
US-20250296939-A1 BENZOTHIOPHENE COMPOUND KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2025-09-25 US disclosed
EP-4516792-A1 BENZOTHIOPHENE COMPOUND Kyoto Pharmaceutical Industries, Ltd. (JP) 2025-03-05 EP 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-20250296939-A1 BENZOTHIOPHENE COMPOUND NFE2L2, KEAP1, BPTF SYK 3053/4885HTR2C 2885/4885SLC6A4 2843/4885

“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.