SCHEMBL9876585

SCHEMBL9876585

CCCN(CCC)P(N)(=O)N(Cl)Cl

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.32
CA12 O43570 2/20 0.31
CA2 P00918 2/20 0.31
CA1 P00915 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CA9 Q16790 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
SCHEMBL9876905 0.86 FDPS (0.36) FDPSCA12CA1CA9
SCHEMBL9216457 0.80
SCHEMBL2788515 0.78 ALDH1A1 (0.41)
SCHEMBL3888615 0.74 FDPS (0.37) FDPSCA12CA2CA1CA14
SCHEMBL11658883 0.73 FDPS (0.30) FDPS
SCHEMBL17524419 0.70 FDPS (0.44) FDPSCA12CA2CA1CA14
SCHEMBL12207961 0.70 ALDH1A1 (0.43) FDPSCA12CA2CA1CA14
SCHEMBL9876483 0.70 CA12 (0.37) CA12CA2CA1CA9
SCHEMBL9503075 0.69 FDPS (0.37) FDPSCA12CA2CA1CA14
SCHEMBL9452618 0.69 FDPS (0.37) FDPSCA12CA2CA1CA14

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
US-5010201-A Process for the preparation of substituted 2-chloropyridines BAYER AKTIENGESELLSCHAFT (DE) 1991-04-23 US disclosed