SCHEMBL10024372

SCHEMBL10024372

CC[C@@H](C)CCCCC1CO1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
EPHX1 P07099 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 2/20 0.31
PRKD3 O94806 1/20 0.30
PRKCG P05129 1/20 0.30
PRKCB P05771 1/20 0.30
PRKCA P17252 1/20 0.30
PRKCH P24723 1/20 0.30
PRKCI P41743 1/20 0.30
PRKCE Q02156 1/20 0.30
PRKCQ Q04759 1/20 0.30
PRKCZ Q05513 1/20 0.30
PRKCD Q05655 1/20 0.30
PRKD1 Q15139 1/20 0.30
SPHK2 Q9NRA0 3/20 0.30
SPHK1 Q9NYA1 3/20 0.30

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
SCHEMBL17472524 0.98 ALDH1A1 (0.57) ALDH1A1EPHX1SMN1; SMN2LMNACYP1A2
SCHEMBL24554547 0.98 ALDH1A1 (0.57) ALDH1A1EPHX1SMN1; SMN2LMNACYP1A2
SCHEMBL15124468 0.94 ALDH1A1 (0.50) ALDH1A1EPHX1SMN1; SMN2
SCHEMBL51987 0.85
SCHEMBL29235825 0.83 ALDH1A1 (0.46) ALDH1A1EPHX1
SCHEMBL3109490 0.80 ALDH1A1 (0.54) ALDH1A1EPHX1SMN1; SMN2LMNASPHK2
SCHEMBL14614620 0.80 ALDH1A1 (0.45) ALDH1A1EPHX1LMNAPRKD3PRKCG
SCHEMBL25312455 0.79 ALDH1A1 (0.59) ALDH1A1EPHX1SMN1; SMN2LMNACYP1A2
SCHEMBL28368930 0.79 ALDH1A1 (0.48) ALDH1A1EPHX1LMNAPRKD3PRKCG
SCHEMBL24542250 0.78 ALDH1A1 (0.46) ALDH1A1EPHX1LMNA

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-1986696-B1 METHOD FOR PRODUCTION OF A TRANSFORMED CELL QIAGEN GMBH (DE) 2012-01-11 EP disclosed