SCHEMBL11856723

SCHEMBL11856723

CCC(=O)C=C(C)C=CCC(C)CCC=C(C)C

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 3/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ LMNA P02545 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ USP2 O75604 1/20 0.36
▸ TSHR P16473 1/20 0.35
▸ GGPS1 O95749 2/20 0.33
▸ FDPS P14324 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ FNTA P49354 1/20 0.33
▸ FNTB P49356 1/20 0.33
▸ GLA P06280 1/20 0.31

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
SCHEMBL11856718 1.00 ALOX15 (0.42) ALOX15ALDH1A1LMNACYP3A4TDP1
SCHEMBL11857693 0.90 ALDH1A1 (0.39) ALOX15ALDH1A1LMNACYP3A4TDP1
SCHEMBL11857697 0.90 ALDH1A1 (0.39) ALOX15ALDH1A1LMNACYP3A4TDP1
SCHEMBL11852657 0.89 ALOX15 (0.40) ALOX15ALDH1A1LMNACYP3A4TDP1
SCHEMBL11852650 0.89 ALOX15 (0.40) ALOX15ALDH1A1LMNACYP3A4TDP1
SCHEMBL11861082 0.86 ALDH1A1 (0.36) ALDH1A1LMNACYP3A4TDP1
SCHEMBL11861076 0.86 ALDH1A1 (0.36) ALDH1A1LMNACYP3A4TDP1
SCHEMBL11850609 0.86 ALOX15 (0.45) ALOX15ALDH1A1LMNACYP3A4TDP1
SCHEMBL11850606 0.86 ALOX15 (0.45) ALOX15ALDH1A1LMNACYP3A4TDP1
SCHEMBL11755834 0.85 KDM4E (0.46) ALOX15ALDH1A1LMNACYP3A4TDP1

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-3940444-A Novel keto-ethers ZOECON CORPORATION (US) 1976-02-24 — — US disclosed
Send feedback