SCHEMBL6201722

SCHEMBL6201722

O=Cc1cc(OC(F)(F)F)ccc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 6/20 0.41
SCN5A Q14524 3/20 0.41
CYP2C9 P11712 2/20 0.41
FFAR1 O14842 1/20 0.41
GPR3 P46089 1/20 0.41
AKR1C2 P52895 1/20 0.39
AKR1C1 Q04828 1/20 0.39
CES1 P23141 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
DRD3 P35462 1/20 0.38
CYP3A4 P08684 2/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
GMNN O75496 1/20 0.37
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL3148079 0.86 TDP1 (0.50) FFAR4SCN5ACYP2C9FFAR1GPR3
SCHEMBL6205088 0.82 GPR3 (0.41) FFAR4SCN5ACYP2C9FFAR1GPR3
SCHEMBL16959124 0.82 FFAR4 (0.41) FFAR4SCN5ACYP2C9FFAR1GPR3
SCHEMBL2824893 0.80 GPR3 (0.42) FFAR4SCN5ACYP2C9FFAR1GPR3
SCHEMBL6500895 0.80 GPR3 (0.42) SCN5ACYP2C9GPR3CES1CYP3A4
SCHEMBL29627452 0.79 ERN1 (0.61) GPR3ERN1EPHX2
SCHEMBL17822065 0.79 GPR3 (0.41) FFAR4SCN5ACYP2C9GPR3CES1
SCHEMBL6092323 0.79 NPC1 (0.44) FFAR4SCN5ACYP2C9GPR3CES1
SCHEMBL1211619 0.79 ERN1 (0.61) GPR3ERN1EPHX2
SCHEMBL26930964 0.79 GAA (0.43) SCN5ACYP2C9GPR3CES1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12479844-B2 Ion channel modulators PRAXIS PRECISION MEDICINES, INC. (US) 2025-11-25 US disclosed
US-20210403476-A1 ION CHANNEL MODULATORS PRAXIS PRECISION MEDICINES, INC. 2021-12-30 US disclosed
US-20210403476-A1 ION CHANNEL MODULATORS PRAXIS PRECISION MEDICINES, INC. 2021-12-30 US disclosed
CN-113573713-A Ion channel modulators 普拉克西斯精密药物股份有限公司 2021-10-29 CN disclosed
EP-3856193-A1 ION CHANNEL MODULATORS Praxis Precision Medicines, Inc. (US) 2021-08-04 EP disclosed
WO-2020069322-A1 ION CHANNEL MODULATORS PRAXIS PRECISION MEDICINES, INC. (US) 2020-04-02 WO disclosed
EP-1551836-A1 AZABICYCLIC AMINE DERIVATIVES AS NK-1 RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LTD. (GB) 2005-07-13 EP disclosed
WO-2004031190-A1 AZABICYCLIC AMINE DERIVATIVES AS NK-1 RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LIMITED (GB) 2004-04-15 WO disclosed
US-6555552-B2 Psychological disorders; analgesics; antiinflammatory agents MERCK SHARP & DOHME LTD. (GB) 2003-04-29 US disclosed
US-20020147212-A1 Azabicyclic amine derivatives and their use as therapeutic agents MERCK SHARP & DOHME LTD. (GB) 2002-10-10 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 (3 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-20210403476-A1 ION CHANNEL MODULATORS SCN1A, SCN3A, SCN2A FFAR4 2492/4885SCN5A 5/4885CYP2C9 3258/4885
US-20020147212-A1 Azabicyclic amine derivatives and their use as therapeutic agents CXCR1, CXCR6, CCR6 FFAR4 492/4885SCN5A 346/4885CYP2C9 1545/4885
US-12479844-B2 Ion channel modulators SCN1A, SCN3A, SCN2A FFAR4 2492/4885SCN5A 5/4885CYP2C9 3258/4885

“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.