SCHEMBL7911266

SCHEMBL7911266

O=S(=O)(NN1CCCCCC1)C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.37
CA2 P00918 3/20 0.37
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
POLB P06746 1/20 0.32
TSHR P16473 1/20 0.31
KMT2A Q03164 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
SCHEMBL31336647 1.00 CA1 (0.37) CA1CA2LMNAMAPK1HTT
SCHEMBL31336572 0.98 CA1 (0.39) CA1CA2LMNAMAPK1HTT
SCHEMBL7910215 0.78 PHGDH (0.42) CA1CA2SMN1; SMN2TSHR
SCHEMBL6308620 0.78 CA1 (0.34) CA1CA2
SCHEMBL7902763 0.74 EPHX2 (0.33) CA1CA2LMNAHTTSMN1; SMN2
SCHEMBL7024977 0.73 CA1 (0.36) CA1CA2HTTPOLBTSHR
SCHEMBL5224904 0.73 CA1 (0.36) CA1CA2POLBTSHRKMT2A
SCHEMBL6335937 0.73 CA1 (0.36) CA1CA2POLBTSHRKMT2A
SCHEMBL27318690 0.71 CA1 (0.35) CA1CA2HTTPOLBTSHR
SCHEMBL7290030 0.70 CA1 (0.32) CA1CA2POLBTSHRKMT2A

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-6211172-B1 ADHESION PREVENTION OF BACTERIA ON SHIP HULLS BUCKMAN LABORATORIES INTERNATIONAL, INC. 2001-04-03 US claimed
US-6211172-B1 ADHESION PREVENTION OF BACTERIA ON SHIP HULLS BUCKMAN LABORATORIES INTERNATIONAL, INC. 2001-04-03 US disclosed