SCHEMBL4837271

SCHEMBL4837271

Cc1ccc(P([N]P(c2ccc(C)cc2)c2ccc(C)cc2)c2ccc(C)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.47
TDP1 Q9NUW8 2/20 0.47
ALDH1A1 P00352 6/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
TSHR P16473 3/20 0.33
LMNA P02545 3/20 0.33
PKM P14618 2/20 0.33
HTT P42858 2/20 0.33
ATM Q13315 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
HPGD P15428 1/20 0.33
NLRP1 Q9C000 1/20 0.33
ALOX12 P18054 1/20 0.33
MEN1 O00255 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
SCHEMBL34181 0.71 ACHE (0.57) ACHETDP1ALDH1A1CA1CA2
SCHEMBL15661400 0.71 ACHE (0.57) ACHETDP1ALDH1A1CA1CA2
SCHEMBL4841322 0.70 TP53 (0.42) TDP1ALDH1A1CA2SMN1; SMN2TSHR
SCHEMBL4830110 0.70 CA1 (0.55) ACHETDP1ALDH1A1CA1CA2
Bromide SCHEMBL7200758 0.69 ACHE (0.53) ACHETDP1ALDH1A1CA1CA2
SCHEMBL5590712 0.69 ACHE (0.53) ACHETDP1ALDH1A1CA1CA2
SCHEMBL7558573 0.69 ACHE (0.53) ACHETDP1ALDH1A1CA1CA2
Hydrochloric Acid SCHEMBL14335453 0.69 ACHE (0.53) ACHETDP1ALDH1A1CA1CA2
SCHEMBL1400954 0.69 ACHE (0.53) ACHETDP1ALDH1A1CA1CA2
Bromide SCHEMBL3676874 0.69 ACHE (0.53) ACHETDP1ALDH1A1CA1CA2

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-7378537-B2 Olefin oligomerization catalysts and methods of using same CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2008-05-27 US disclosed
US-20080027188-A1 OLEFIN OLIGOMERIZATION CATALYSTS AND METHODS OF USING SAME CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2008-01-31 US disclosed