SCHEMBL28981480

SCHEMBL28981480

Cc1cc(N2CCCc3cc(F)c(F)cc3C2)c(Cl)c(C)c1C(C(N)=O)C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.33
▸ KCNQ2 O43526 3/20 0.31
▸ RORC P51449 1/20 0.30
▸ AVPR1A P37288 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
SCHEMBL30274615 1.00 TSHR (0.33) TSHRKCNQ2RORCAVPR1A
SCHEMBL31519840 0.89 KCNQ2 (0.40) KCNQ2
SCHEMBL28981444 0.83 KCNQ2 (0.42) TSHRKCNQ2
SCHEMBL31519835 0.80 KCNQ2 (0.42) KCNQ2
SCHEMBL28981479 0.79 KCNQ2 (0.33) TSHRKCNQ2
SCHEMBL25101356 0.76 KCNQ2 (0.54) KCNQ2
SCHEMBL30205907 0.76 KCNQ2 (0.54) KCNQ2
SCHEMBL30274596 0.75 MAOB (0.43) KCNQ2
SCHEMBL27400295 0.74 KCNQ2 (0.31) TSHRKCNQ2
SCHEMBL31519832 0.74 KCNQ2 (0.37) KCNQ2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115724799-A Potassium channel regulator, composition and application 杭州和正医药有限公司 2023-03-03 — — CN disclosed
Send feedback