SCHEMBL13120130

SCHEMBL13120130

CC(C)C1OC(=O)C(C)[C@@H](O)C1C

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 2/20 0.35
▸ THRB P10828 2/20 0.35
▸ DNMT1 P26358 1/20 0.35
▸ CTDSP1 Q9GZU7 1/20 0.35
▸ MANBA O00462 1/20 0.35
▸ IDUA P35475 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ GUSB P08236 1/20 0.35
▸ CYP2C19 P33261 1/20 0.32
▸ ALOX15 P16050 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL13105442 1.00 HIF1A (0.35) HIF1ATHRBDNMT1CTDSP1MANBA
SCHEMBL10110534 0.85 MEN1 (0.31) MEN1KMT2A
SCHEMBL13120133 0.82 HIF1A (0.35) HIF1ATHRBDNMT1CTDSP1MANBA
SCHEMBL13105443 0.82 HIF1A (0.35) HIF1ATHRBDNMT1CTDSP1MANBA
SCHEMBL7937980 0.79 HIF1A (0.41) HIF1ATHRBDNMT1CTDSP1MANBA
SCHEMBL17973347 0.78 — —
SCHEMBL10035728 0.78 — —
SCHEMBL12833579 0.77 HIF1A (0.34) HIF1ATHRBDNMT1CTDSP1MANBA
SCHEMBL14503356 0.76 — —
SCHEMBL14050104 0.74 MEN1 (0.33) LMNAMEN1KMT2A

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-7807418-B2 Method for producing hybrid polyketide synthases BIOTICA TECHNOLOGY LIMITED (GB) 2010-10-05 — — US disclosed
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