SCHEMBL6549339

SCHEMBL6549339

Cc1cc(C(C)(C)C)c(-c2ccccc2P(O)Cl)c(C(C)(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CA2 P00918 1/20 0.39
POLB P06746 1/20 0.39
TYR P14679 1/20 0.39
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HSPA5 P11021 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
PDK2 Q15119 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
SCHEMBL11301324 0.93 PDK2 (0.37) ALDH1A1SMN1; SMN2CA2POLBTYR
SCHEMBL11568620 0.88 TSHR (0.35) ALDH1A1TSHRTDP1CYP2C9CYP2C19
SCHEMBL11571137 0.85 CA2 (0.39) ALDH1A1CA2TSHRTDP1
SCHEMBL11300507 0.80 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2CA2POLBTYR
SCHEMBL8359846 0.78 SMN1; SMN2 (0.39) ALDH1A1SMN1; SMN2CA2POLBTYR
SCHEMBL11486500 0.76 IDO1 (0.33) ALDH1A1SMN1; SMN2CA2POLBTYR
SCHEMBL11321359 0.75 GAA (0.40) ALDH1A1SMN1; SMN2
SCHEMBL4154405 0.74 TSHR (0.37) ALDH1A1CA2TSHRTDP1CYP2C9
SCHEMBL11569511 0.74 ALDH1A1 (0.42) ALDH1A1TSHRTDP1CYP2C9CYP2C19
SCHEMBL10938205 0.72 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2CA2POLBTYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1383833-A1 GRANULAR POLYMER ADDITIVES AND THEIR PREPARATION ALBEMARLE CORPORATION (US) 2004-01-28 EP disclosed
EP-1363972-A1 GRANULAR POLYMER ADDITIVES AND THEIR PREPARATION ALBEMARLE CORPORATION (US) 2003-11-26 EP disclosed
US-6515052-B2 Granular polymer additives and their preparation ALBEMARLE CORPORATION 2003-02-04 US disclosed
WO-2002068523-A1 GRANULAR POLYMER ADDITIVES AND THEIR PREPARATION ALBEMARLE CORPORATION (US) 2002-09-06 WO disclosed
WO-2002068524-A1 GRANULAR POLYMER ADDITIVES AND THEIR PREPARATION ALBEMARLE CORPORATION (US) 2002-09-06 WO disclosed
US-20020117651-A1 Granular polymer additives and their preparation ALBEMARLE CORPORATION 2002-08-29 US disclosed
EP-0004026-B1 HYDROLYTICALLY STABLE ORTHO-ALKYLATED PHENYL PHOSPHONITES AND STABILIZED COMPOSITIONS CIBA-GEIGY AG (CH) 1982-05-05 EP disclosed