SCHEMBL21632343

SCHEMBL21632343

CC(CN)(C(=O)O)c1ccccc1F

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KCNN4 O15554 6/20 0.47
▸ KCNE1 P15382 1/20 0.46
▸ KCNQ1 P51787 1/20 0.46
▸ PTGFR P43088 3/20 0.40
▸ CYP2C19 P33261 2/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ KIF11 P52732 2/20 0.37
▸ TAAR1 Q96RJ0 1/20 0.37
▸ HDAC3 O15379 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC2 Q92769 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37
▸ RIPK1 Q13546 1/20 0.36
▸ ESR2 Q92731 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ KMT2A Q03164 1/20 0.35

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
SCHEMBL18113458 0.81 KCNN4 (0.46) KCNN4KCNE1KCNQ1PTGFRCYP2C19
SCHEMBL21631960 0.81 PTGFR (0.38) KCNN4KCNE1KCNQ1PTGFRCYP2C19
SCHEMBL21632104 0.79 KCNN4 (0.42) KCNN4PTGFRKIF11TAAR1MAPT
SCHEMBL27448763 0.79 KCNN4 (0.44) KCNN4KCNE1KCNQ1PTGFRCYP2C19
SCHEMBL21631996 0.78 CYP2C19 (0.53) KCNN4KCNE1KCNQ1PTGFRCYP2C19
SCHEMBL21632350 0.77 GAA (0.44) PTGFRTAAR1KMT2A
SCHEMBL714233 0.77 KCNN4 (0.51) KCNN4KCNE1KCNQ1CYP2C19HIF1A
SCHEMBL935388 0.77 KCNN4 (0.51) KCNN4KCNE1KCNQ1CYP2C19HIF1A
SCHEMBL15535815 0.77 KCNN4 (0.51) KCNN4KCNE1KCNQ1CYP2C19HIF1A
SCHEMBL23453194 0.76 TAAR1 (0.54) KCNN4CYP2C19HIF1AKIF11TAAR1

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
US-11136296-B2 Substituted N-arylethyl-2-arylquinoline-4-carboxamides and use thereof BAYER AKTIENGESELLSCHAFT (DE) 2021-10-05 — — US disclosed
EP-3609869-A1 SUBSTITUTED N-ARYLETHYL-2-ARYLQUINOLINE-4-CARBOXAMIDES AND USE THEREOF Bayer Aktiengesellschaft (DE) 2020-02-19 — — EP disclosed
US-20200031775-A1 SUBSTITUTED N-ARYLETHYL-2-ARYLQUINOLINE-4-CARBOXAMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-01-30 — — 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 (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-20200031775-A1 SUBSTITUTED N-ARYLETHYL-2-ARYLQUINOLINE-4-CARBOXAMIDES AND USE THEREOF AADAC, NAT1, EPX KCNN4 4303/4885KCNE1 3445/4885KCNQ1 2389/4885
US-11136296-B2 Substituted N-arylethyl-2-arylquinoline-4-carboxamides and use thereof AADAC, NAT1, EPX KCNN4 4303/4885KCNE1 3445/4885KCNQ1 2389/4885

“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.

Send feedback