SCHEMBL11761209

SCHEMBL11761209

CCC(C)(C)CCCC(C)C/C=C/C(C)=C/C(=O)OC

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.61
▸ LMNA P02545 1/20 0.61
▸ CYP3A4 P08684 1/20 0.61
▸ TDP1 Q9NUW8 1/20 0.61

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
SCHEMBL11761210 1.00 ALDH1A1 (0.61) ALDH1A1LMNACYP3A4TDP1
SCHEMBL11761983 0.89 ALDH1A1 (0.57) ALDH1A1LMNACYP3A4TDP1
SCHEMBL11770707 0.89 ALDH1A1 (0.74) ALDH1A1LMNACYP3A4TDP1
SCHEMBL11862999 0.89 ALDH1A1 (0.60) ALDH1A1LMNACYP3A4TDP1
SCHEMBL11770700 0.89 ALDH1A1 (0.74) ALDH1A1LMNACYP3A4TDP1
SCHEMBL11862996 0.89 ALDH1A1 (0.60) ALDH1A1LMNACYP3A4TDP1
SCHEMBL11761976 0.89 ALDH1A1 (0.57) ALDH1A1LMNACYP3A4TDP1
SCHEMBL11762627 0.88 ALDH1A1 (0.65) ALDH1A1LMNACYP3A4TDP1
SCHEMBL11762624 0.88 ALDH1A1 (0.65) ALDH1A1LMNACYP3A4TDP1
SCHEMBL11858098 0.88 ALDH1A1 (0.59) 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