SCHEMBL8093225

SCHEMBL8093225

PC(c1[c]cccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.32
KCNN4 O15554 1/20 0.32
ALDH1A1 P00352 1/20 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
SCHEMBL2834335 0.77 KCNN4 (0.35) TSHRKCNN4ALDH1A1
SCHEMBL11685097 0.76 TSHR (0.44) TSHRKCNN4ALDH1A1
SCHEMBL10613886 0.74 ESR1 (0.43) TSHRKCNN4ALDH1A1
SCHEMBL8308460 0.74 TSHR (0.42) TSHRKCNN4ALDH1A1
SCHEMBL2599011 0.74 TSHR (0.42) TSHRKCNN4ALDH1A1
SCHEMBL960514 0.74 ESR1 (0.43) KCNN4ALDH1A1
SCHEMBL8875139 0.74 ESR1 (0.43) TSHRKCNN4ALDH1A1
SCHEMBL6450582 0.74 KCNN4 (0.54) TSHRKCNN4ALDH1A1
SCHEMBL1042104 0.74
SCHEMBL416260 0.72 KCNN4 (0.47) TSHRKCNN4ALDH1A1

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
EP-1024899-A1 METHOD FOR PRODUCING SUPPORTED TRANSITION METAL CATALYSTS BASF AKTIENGESELLSCHAFT (DE) 2000-08-09 EP disclosed
WO-1999020392-A1 METHOD FOR PRODUCING SUPPORTED TRANSITION METAL CATALYSTS BASF AKTIENGESELLSCHAFT (DE) 1999-04-29 WO disclosed