SCHEMBL15424092

SCHEMBL15424092

CCCCC(CCC)CCBr

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
CYP3A4 P08684 4/20 0.41
TSHR P16473 4/20 0.41
LMNA P02545 2/20 0.37
DNM1 Q05193 2/20 0.36
CA2 P00918 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ATM Q13315 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
FDPS P14324 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
SCHEMBL1976929 0.95 ALDH1A1 (0.46) ALDH1A1TDP1CYP3A4TSHRLMNA
SCHEMBL27875897 0.90 ALDH1A1 (0.42) ALDH1A1TDP1CYP3A4TSHRLMNA
SCHEMBL15075502 0.89 CA12 (0.32) ALDH1A1TSHRCA2
SCHEMBL1996190 0.89 CA12 (0.32) ALDH1A1TSHRCA2
SCHEMBL28063103 0.87 LMNA (0.52) ALDH1A1TDP1CYP3A4TSHRLMNA
SCHEMBL1995540 0.86 LMNA (0.50) ALDH1A1TDP1CYP3A4TSHRLMNA
SCHEMBL18107268 0.86 LMNA (0.50) ALDH1A1TDP1CYP3A4TSHRLMNA
SCHEMBL5424467 0.86 ALDH1A1 (0.52) ALDH1A1TDP1CYP3A4TSHRLMNA
SCHEMBL824882 0.86 ALDH1A1 (0.52) ALDH1A1TDP1CYP3A4TSHRLMNA
SCHEMBL18107409 0.84 LMNA (0.54) ALDH1A1TSHRLMNADNM1FDPS

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-9793486-B2 Polymer compound and light-emitting element using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-17 US disclosed
US-20140014935-A1 POLYMER COMPOUND AND LIGHT-EMITTING ELEMENT USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-01-16 US disclosed