SCHEMBL9268296

SCHEMBL9268296

NC(=O)Oc1c(CCl)no[n+]1[O-]

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
TBXA2R P21731 1/20 0.34
MAPT P10636 1/20 0.30
GLA P06280 1/20 0.30
ABCB1 P08183 1/20 0.30
ABCC1 P33527 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
SCHEMBL9272550 0.85 CA12 (0.37) CA12CA1CA2CA9TBXA2R
SCHEMBL8785232 0.85 CA12 (0.37) CA12CA1CA2CA9TBXA2R
SCHEMBL9259468 0.81 LMNA (0.39) CA12CA1CA2CA9TBXA2R
SCHEMBL9271321 0.81 CA12 (0.35) CA12CA1CA2CA9TBXA2R
Hydrochloric Acid SCHEMBL9258721 0.76 TBXA2R (0.33) CA12CA1CA2CA9TBXA2R
SCHEMBL9272708 0.76 MAPT (0.33) CA12CA1CA2CA9TBXA2R
SCHEMBL9260535 0.76 TBXA2R (0.33) CA12CA1CA2CA9TBXA2R
SCHEMBL9267372 0.74 MAPT (0.33) CA12CA1CA2CA9TBXA2R
Hydrochloric Acid SCHEMBL9271471 0.74 CA12 (0.31) CA12CA1CA2CA9
SCHEMBL9267036 0.70 TBXA2R (0.38) CA12CA1CA2CA9TBXA2R

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
WO-1995019355-A1 FURAZAN CARBOXYLIC ACID DERIVATIVES HOECHST AKTIENGESELLSCHAFT (DE) 1995-07-20 WO disclosed