SCHEMBL7965780

SCHEMBL7965780

CCCCC(CC)O[P](=O)O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.38
CA1 P00915 4/20 0.38
PRKCA P17252 1/20 0.38
PRKCD Q05655 1/20 0.38
CTSK P43235 1/20 0.38
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 1/20 0.35
DNM1 Q05193 2/20 0.34
TSHR P16473 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
FDPS P14324 1/20 0.34
CYP3A4 P08684 2/20 0.34
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL7961607 0.87 PRKCA (0.35) PRKCAPRKCDTSHRFDPSCYP3A4
SCHEMBL5678037 0.77 LMNA (0.37) CA1PRKCAPRKCDDNM1FDPS
SCHEMBL3171638 0.77 LMNA (0.37) CA2CA1DNM1FDPS
SCHEMBL7963024 0.77 ALDH1A1 (0.37) CA2CA1MAPK1ALDH1A1DNM1
SCHEMBL6847355 0.75 LMNA (0.35) CA1PRKCAPRKCDDNM1FDPS
SCHEMBL1261297 0.75 LMNA (0.40) DNM1FDPS
SCHEMBL1261495 0.75 LMNA (0.40) DNM1FDPS
SCHEMBL1259447 0.75 LMNA (0.40) DNM1FDPS
SCHEMBL11060411 0.75 LMNA (0.40) DNM1FDPS
SCHEMBL1260707 0.75 LMNA (0.40) DNM1FDPS

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1302298-A Substituted (4-brompyrazole-3-yl) indole BASF AG (DE) 2001-07-04 CN disclosed
US-6204222-B1 SUITABLE AS HERBICIDES AND FOR DESICCATION/DEFOLIATION OF PLANTS BASF AKTIENGESELLSCHAFT (DE) 2001-03-20 US disclosed
EP-0637298-B1 SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM BASF AG (DE) 1999-03-31 EP disclosed
US-5817603-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-10-06 US disclosed