SCHEMBL31346005

SCHEMBL31346005

Cc1cc(C#N)cc(C2Cc3cc(C(F)(F)F)ccc3O2)c1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.34
CYP3A4 P08684 2/20 0.34
EGLN1 Q9GZT9 1/20 0.33
TERT O14746 1/20 0.33
KIF11 P52732 1/20 0.33
CYP2C9 P11712 2/20 0.32
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MAOB P27338 9/20 0.32
MRGPRX4 Q96LA9 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
SCHEMBL31346109 1.00 ELANE (0.34) ELANECYP3A4EGLN1TERTKIF11
SCHEMBL31346114 0.92 KIF11 (0.36) ELANECYP3A4EGLN1KIF11MRGPRX4
SCHEMBL31346129 0.87 TRPM5 (0.35) ELANECYP3A4EGLN1KIF11MAOB
SCHEMBL31345991 0.85 ABCG2 (0.37) CYP3A4MAOB
SCHEMBL31346117 0.83 CYP19A1 (0.45) ELANECYP3A4KIF11MRGPRX4
SCHEMBL31345995 0.83 CYP19A1 (0.45) ELANECYP3A4KIF11MRGPRX4
SCHEMBL31346060 0.82 TERT (0.34) TERTMAOB
SCHEMBL31346038 0.82 TERT (0.34) TERTMAOB
SCHEMBL31346029 0.81 CYP11B1 (0.40) CYP3A4EGLN1KIF11
SCHEMBL31346086 0.80 MRGPRX4 (0.34) ELANEEGLN1KIF11MRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4712967-A2 G-PROTEIN COUPLED RECEPTOR ANTAGONIST Enveda Therapeutics, Inc. (US) 2026-03-25 EP disclosed
WO-2024239000-A2 G-PROTEIN COUPLED RECEPTOR ANTAGONIST ENVEDA THERAPEUTICS, INC. (US) 2024-11-21 WO disclosed