SCHEMBL15095691

SCHEMBL15095691

C[C@@H]1C(C)(C)C2CC[C@@H](C)[C@@]2(C)CC[C@@]1(C)OC=O

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ CYP17A1 P05093 1/20 0.30
▸ CYP19A1 P11511 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
SCHEMBL15095711 0.80 ALOX15 (0.36) ALOX15ALDH1A1LMNATHRBMAPK1
SCHEMBL15095716 0.77 ALOX15 (0.57) ALOX15ALDH1A1LMNATHRBMAPK1
SCHEMBL17340687 0.74 ALOX15 (0.31) ALOX15
SCHEMBL3506539 0.73 ALOX15 (0.64) ALOX15ALDH1A1LMNATHRBMAPK1
SCHEMBL8737958 0.73 ALOX15 (0.64) ALOX15ALDH1A1LMNATHRBMAPK1
SCHEMBL14252530 0.73 ALOX15 (0.64) ALOX15ALDH1A1LMNATHRBMAPK1
Ammonia Solution, Strong SCHEMBL11222759 0.62 MAPT (0.31) —
SCHEMBL28376790 0.59 — —
SCHEMBL24066735 0.58 ALOX15 (0.37) ALOX15ALDH1A1LMNATHRBMAPK1
SCHEMBL18138230 0.57 ALOX15 (0.65) ALOX15ALDH1A1LMNATHRBMAPK1

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-8481592-B2 Uses of sesquiterpene derivatives KWANG DONG PHARM CO., LTD. (KR) 2013-07-09 — — US disclosed
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