SCHEMBL4518422

SCHEMBL4518422

OOOOC1CCCCCCCCCCCCCCC1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA12 O43570 2/20 0.36
CA9 Q16790 2/20 0.36
EPHX1 P07099 2/20 0.32

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
SCHEMBL3476191 1.00 CA1 (0.36) CA1CA2CA12CA9EPHX1
SCHEMBL15539473 1.00 CA1 (0.36) CA1CA2CA12CA9EPHX1
SCHEMBL12831207 0.97
SCHEMBL3476719 0.92 CA1 (0.34) CA1CA2CA12CA9EPHX1
SCHEMBL13372060 0.90 CA1 (0.33) CA1CA2CA12CA9EPHX1
SCHEMBL11960378 0.89 CA12 (0.32) CA1CA2CA12CA9
SCHEMBL14013212 0.86 CA12 (0.31) CA1CA2CA12CA9
SCHEMBL9970660 0.85
SCHEMBL737764 0.83
SCHEMBL1014496 0.82

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
US-20120123638-A1 SYSTEM FOR CONTROLLING VEHICLE EQUIPMENT BECHTEL JON H (US) 2012-05-17 US disclosed
US-20120116632-A1 SYSTEM FOR CONTROLLING VEHICLE EQUIPMENT BECHTEL JON H (US) 2012-05-10 US disclosed