SCHEMBL29660969

SCHEMBL29660969

FC(F)=Cc1cc(F)c(Br)cc1OCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KDM1A O60341 3/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
CCR5 P51681 1/20 0.41
NPC1 O15118 2/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
PTGER1 P34995 1/20 0.40
USP28 Q96RU2 1/20 0.40
USP25 Q9UHP3 1/20 0.40
ERN1 O75460 1/20 0.39
HTT P42858 1/20 0.39
PTPN1 P18031 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 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
SCHEMBL22918393 1.00 RAB9A (0.45) RAB9ASMN1; SMN2KDM1AGAAMAPT
SCHEMBL22918166 0.83 ERN1 (0.48) RAB9ASMN1; SMN2KDM1AGAAMAPT
SCHEMBL23599560 0.82 CCR5 (0.60) RAB9ASMN1; SMN2MAPTCCR5NPC1
SCHEMBL20521874 0.81 KDM1A (0.48) RAB9ASMN1; SMN2KDM1AMAPTNPC1
SCHEMBL30221893 0.81 KDM1A (0.48) RAB9ASMN1; SMN2KDM1AMAPTNPC1
SCHEMBL26087192 0.79 ERN1 (0.47) RAB9ASMN1; SMN2KDM1AGAAMAPT
SCHEMBL24631045 0.78 NPC1 (0.43) RAB9ASMN1; SMN2KDM1ANPC1MRGPRX4
SCHEMBL416139 0.77 KDM1A (0.48) RAB9ASMN1; SMN2KDM1AMAPTNPC1
SCHEMBL22918092 0.77 ELANE (0.47) RAB9ASMN1; SMN2KDM1ACCR5NPC1
SCHEMBL19667234 0.77 FOLH1 (0.56) NPC1MRGPRX4PTGER1ALDH1A1

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
CN-114616226-B Pyridine derivatives as TMEM16A modulators for the treatment of respiratory disorders TMEM16A有限公司 2025-03-04 CN disclosed
CN-114616226-A Pyridine derivatives as TMEM16A modulators for the treatment of respiratory disorders TMEM16A有限公司 2022-06-10 CN disclosed
EP-4003516-A1 PYRIDINE DERIVATIVES AS TMEM16A MODULATORS FOR USE IN THE TREATMENT OF RESPIRATORY CONDITIONS TMEM16A LIMITED (GB) 2022-06-01 EP disclosed