SCHEMBL11761983

SCHEMBL11761983

CCOC(=O)C=C(C)C=CCC(C)CCCC(C)(C)CC

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.57
▸ LMNA P02545 1/20 0.57
▸ CYP3A4 P08684 1/20 0.57
▸ TDP1 Q9NUW8 1/20 0.57
▸ MAPT P10636 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ HCAR2 Q8TDS4 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
SCHEMBL11761976 1.00 ALDH1A1 (0.57) ALDH1A1LMNACYP3A4TDP1MAPT
SCHEMBL11762874 0.90 ALDH1A1 (0.59) ALDH1A1LMNACYP3A4TDP1MAPT
SCHEMBL11762865 0.90 ALDH1A1 (0.59) ALDH1A1LMNACYP3A4TDP1MAPT
SCHEMBL11861347 0.89 ALDH1A1 (0.56) ALDH1A1LMNACYP3A4TDP1MAPT
SCHEMBL11861351 0.89 ALDH1A1 (0.56) ALDH1A1LMNACYP3A4TDP1MAPT
SCHEMBL11873272 0.89 ALDH1A1 (0.56) ALDH1A1LMNACYP3A4TDP1MAPT
SCHEMBL11873277 0.89 ALDH1A1 (0.56) ALDH1A1LMNACYP3A4TDP1MAPT
SCHEMBL11863322 0.89 ALDH1A1 (0.58) ALDH1A1LMNACYP3A4TDP1MAPT
SCHEMBL11863325 0.89 ALDH1A1 (0.58) ALDH1A1LMNACYP3A4TDP1MAPT
SCHEMBL11761209 0.89 ALDH1A1 (0.61) ALDH1A1LMNACYP3A4TDP1

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-4021461-A INSECTICIDES ZOECON CORPORATION (US) 1977-05-03 — — US disclosed
Send feedback