Sugi Predict

Sugi Predict / Compounds / SCHEMBL5528995

SCHEMBL5528995

SCHEMBL5528995

[CH2]C(C)CCCCCCC(CC)CC

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ CYP3A4 P08684 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ CA2 P00918 1/20 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
SCHEMBL29073426 0.97 ALDH1A1 (0.39) ALDH1A1TDP1LMNACYP3A4TSHR
SCHEMBL17607511 0.92 ALDH1A1 (0.39) ALDH1A1TDP1CYP3A4TSHRL3MBTL1
SCHEMBL29064488 0.85 ALDH1A1 (0.50) ALDH1A1TDP1LMNACYP3A4TSHR
SCHEMBL5986975 0.83 ALDH1A1 (0.33) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL25341506 0.83 ALDH1A1 (0.48) ALDH1A1TDP1LMNACYP3A4TSHR
SCHEMBL7008843 0.83 TRPV1 (0.36) LMNA
SCHEMBL11578114 0.83 ALDH1A1 (0.48) ALDH1A1TDP1LMNACYP3A4TSHR
SCHEMBL7006597 0.83 TRPV1 (0.36) LMNA
SCHEMBL10986825 0.83 TRPV1 (0.36) LMNA
SCHEMBL232186 0.80 ALDH1A1 (0.31) ALDH1A1TDP1TSHR

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-20070213206-A1 MAGNESIUM COMPOUND, SOLID CATALYST COMPONENT, OLEFIN POLYMERIZATION CATALYST, AND METHOD FOR PRODUCING POLYOLEFIN IDEMITSU KOSAN CO.,LTD (JP) 2007-09-13 — — US disclosed