SCHEMBL28696659

SCHEMBL28696659

N#Cc1cc(N)ccc1Oc1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 9/20 0.67
AR P10275 11/20 0.60

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
SCHEMBL28932082 0.89 AR (0.65) AR
SCHEMBL28689163 0.86 AR (0.61) PLA2G7AR
SCHEMBL875634 0.85 AR (0.60) PLA2G7AR
SCHEMBL876881 0.85 AR (0.60) PLA2G7AR
SCHEMBL15096357 0.85 AR (0.60) PLA2G7AR
SCHEMBL9107703 0.84 PLA2G7 (0.56) PLA2G7AR
SCHEMBL875646 0.84 AR (0.56) PLA2G7AR
SCHEMBL28677206 0.84 KDM4E (0.53) PLA2G7AR
SCHEMBL28288101 0.84 HTR2A (0.55) PLA2G7AR
SCHEMBL28697603 0.83 SLC22A12 (0.51) PLA2G7AR

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-109651208-B N-aryl sulfonamide compound, pharmaceutical composition and application thereof 中国科学院上海药物研究所 2022-01-04 CN disclosed