SCHEMBL3451192

SCHEMBL3451192

FC(F)(F)c1cc(I)c(Br)cn1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.38
CA2 P00918 1/20 0.36
CHKA P35790 1/20 0.36
LOXL2 Q9Y4K0 2/20 0.32
LOX P28300 1/20 0.32
IDO1 P14902 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
SCHEMBL17949359 0.80 TRPV4 (0.41) TRPV4CA2CHKALOXL2LOX
SCHEMBL30593162 0.77 NT5E (0.41) TRPV4CA2CHKALOXL2LOX
SCHEMBL30340741 0.77 TRPV4 (0.39) TRPV4CA2CHKALOXL2LOX
SCHEMBL29002089 0.77 TRPV4 (0.39) TRPV4CA2CHKALOXL2LOX
SCHEMBL31119088 0.77 TRPV4 (0.39) TRPV4CA2CHKALOXL2LOX
SCHEMBL17574583 0.77 TRPV4 (0.39) TRPV4CA2CHKALOXL2LOX
SCHEMBL19899650 0.75 CA2 (0.45) TRPV4CA2CHKALOXL2LOX
SCHEMBL2998384 0.75 HSP90AA1 (0.38) TRPV4CA2CHKALOXL2LOX
SCHEMBL22448607 0.75 TRPV4 (0.38) TRPV4CA2CHKALOXL2LOX
SCHEMBL2225528 0.75 CA2 (0.45) TRPV4CA2CHKALOXL2LOX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250026721-A1 COMPOUNDS AND METHODS FOR MODULATING RAS-PI3K VIVIDION THERAPEUTICS, INC. 2025-01-23 US disclosed
US-20100029643-A1 HETEROCYCLYC SULFONAMIDES HAVING EDG-1 ANTAGONISTIC ACTIVITY ASTRAZENECA AB (SE) 2010-02-04 US disclosed
CN-101611018-A Heterocyclic sulfonamide with Edg-I antagonistic activity ASTRAZENECA AB (SE) 2009-12-23 CN disclosed
EP-2094670-A1 HETEROCYCLYC SULFONAMIDES HAVING EDG-I ANTAGONISTIC ACTIVITY AstraZeneca AB (SE) 2009-09-02 EP disclosed
WO-2008056150-A1 HETEROCYCLYC SULFONAMIDES HAVING EDG-I ANTAGONISTIC ACTIVITY ASTRAZENECA AB (SE) 2008-05-15 WO 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 (2 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-20250026721-A1 COMPOUNDS AND METHODS FOR MODULATING RAS-PI3K KRAS, HRAS, NRAS TRPV4 4643/4885CA2 3649/4885CHKA 1318/4885
US-20100029643-A1 HETEROCYCLYC SULFONAMIDES HAVING EDG-1 ANTAGONISTIC ACTIVITY EDF1, ERLIN1, ECE1 TRPV4 3498/4885CA2 584/4885CHKA 4459/4885

“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.