SCHEMBL7540476

SCHEMBL7540476

C(CCCCCCCCCC1CO1)CCCCCCCCC1CO1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.74
EPHX1 P07099 1/20 0.46
TDP1 Q9NUW8 2/20 0.42
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TP53 P04637 1/20 0.33
HBB P68871 1/20 0.33
CYP1A2 P05177 2/20 0.32
PRKD3 O94806 2/20 0.32
PRKCG P05129 2/20 0.32
PRKCB P05771 2/20 0.32
PRKCA P17252 2/20 0.32
PRKCH P24723 2/20 0.32
PRKCI P41743 2/20 0.32
PRKCE Q02156 2/20 0.32
PRKCQ Q04759 2/20 0.32
PRKCZ Q05513 2/20 0.32
PRKCD Q05655 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
SCHEMBL1535670 1.00 ALDH1A1 (0.74) ALDH1A1EPHX1TDP1TSHRSMN1; SMN2
SCHEMBL517124 1.00 ALDH1A1 (0.74) ALDH1A1EPHX1TDP1TSHRSMN1; SMN2
SCHEMBL4539533 1.00 ALDH1A1 (0.74) ALDH1A1EPHX1TDP1TSHRSMN1; SMN2
SCHEMBL9294363 1.00 ALDH1A1 (0.74) ALDH1A1EPHX1TDP1TSHRSMN1; SMN2
SCHEMBL8497654 1.00 ALDH1A1 (0.74) ALDH1A1EPHX1TDP1TSHRSMN1; SMN2
SCHEMBL13294288 1.00 ALDH1A1 (0.74) ALDH1A1EPHX1TDP1TSHRSMN1; SMN2
SCHEMBL6412678 1.00 ALDH1A1 (0.74) ALDH1A1EPHX1TDP1TSHRSMN1; SMN2
SCHEMBL7864302 1.00 ALDH1A1 (0.74) ALDH1A1EPHX1TDP1TSHRSMN1; SMN2
SCHEMBL7856005 1.00 ALDH1A1 (0.74) ALDH1A1EPHX1TDP1TSHRSMN1; SMN2
SCHEMBL20702046 1.00 ALDH1A1 (0.74) ALDH1A1EPHX1TDP1TSHRSMN1; SMN2

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
US-20020086161-A1 Radiation-curable compositions and cured articles SUNCOLOR CORPORATION 2002-07-04 US disclosed