SCHEMBL8419229

SCHEMBL8419229

CC1CC(=O)C2=C1CCCCC2

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.40
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA4 P22748 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.31
▸ TRIM24 O15164 1/20 0.31
▸ TRIM33 Q9UPN9 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
SCHEMBL11572154 1.00 KMT2A (0.40) KMT2ACA1CA2CA4ALDH1A1
SCHEMBL4288322 0.98 CA1 (0.38) KMT2ACA1CA2CA4
SCHEMBL21940584 0.93 CA1 (0.33) KMT2ACA1CA2CA4
SCHEMBL19141681 0.72 CA1 (0.35) KMT2ACA1CA2CA4
SCHEMBL22388204 0.72 TLR4 (0.33) KMT2ACA1CA2CA4
SCHEMBL22388203 0.72 TLR4 (0.33) KMT2ACA1CA2CA4ALDH1A1
SCHEMBL20464012 0.70 — —
SCHEMBL4290685 0.69 — —
SCHEMBL1660610 0.68 KMT2A (0.34) KMT2ACA1CA2CA4
SCHEMBL2044296 0.68 KMT2A (0.34) KMT2ACA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0945458-A2 Transition metal compound, polymerization catalyst comprising it, and method for producing polymers using the polymerization catalyst IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1999-09-29 — — EP disclosed
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