SCHEMBL31359634

SCHEMBL31359634

COc1c(Br)ccc(N)c1NCC(C)(F)F

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
MAPT P10636 2/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30
ALOX15 P16050 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL25754003 0.80 MEN1 (0.36) ALOX5APFEN1MAPTMEN1USP2
SCHEMBL31359641 0.77 TUBB4A (0.38) MAPTMEN1KMT2A
SCHEMBL31688065 0.69 MBOAT4 (0.36)
SCHEMBL27766509 0.67 ALOX5AP (0.45) ALOX5APFEN1CA2MAPTMEN1
SCHEMBL11939075 0.67 ALOX5AP (0.53) ALOX5APFEN1CA2MAPTMEN1
SCHEMBL1675886 0.67 ALOX5AP (0.49) ALOX5APFEN1CA2MAPTMEN1
SCHEMBL2964912 0.66 ALOX5AP (0.39) ALOX5APFEN1CA2MAPTLMNA
SCHEMBL1519286 0.66 ALOX5AP (0.40) ALOX5APFEN1CA2MAPTMEN1
SCHEMBL29514108 0.66 ALOX5AP (0.40) ALOX5APFEN1CA2MAPTMEN1
SCHEMBL26654609 0.64 ALOX5AP (0.39) ALOX5APFEN1CA2MAPTMEN1

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
EP-4727935-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF Lynk Pharmaceuticals Co. Ltd. (CN) 2026-04-22 EP disclosed
WO-2024255886-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-12-19 WO disclosed
WO-2024254832-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-12-19 WO disclosed