SCHEMBL11418989

SCHEMBL11418989

CCO[C@H]1CC[C@@]2(C)[C@@H](CC=C3[C@@H]2CC[C@]2(C)[C@@H]([C@H](C)CCCC(C)C)C[C@@H](O)[C@@]32CC)C1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ USP2 O75604 3/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ HMGCR P04035 2/20 0.48
▸ POLA1 P09884 2/20 0.39
▸ CDC25A P30304 2/20 0.39
▸ DHCR24 Q15392 5/20 0.39
▸ NPC1L1 Q9UHC9 3/20 0.37
▸ EBP Q15125 2/20 0.37
▸ LMNA P02545 2/20 0.35
▸ ABCB1 P08183 1/20 0.35
▸ OSBP P22059 1/20 0.35
▸ RORC P51449 1/20 0.35
▸ OSBP2 Q969R2 1/20 0.35
▸ CYP46A1 Q9Y6A2 1/20 0.35
▸ TP53 P04637 1/20 0.35

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
SCHEMBL11417246 1.00 MEN1 (0.50) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL11412948 1.00 MEN1 (0.50) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL11418226 0.93 MEN1 (0.50) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL11411671 0.90 DHCR24 (0.51) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL11412303 0.89 USP2 (0.63) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL11412547 0.89 USP2 (0.63) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL11411742 0.88 USP2 (0.52) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL11421722 0.86 HMGCR (0.44) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL11420198 0.86 HMGCR (0.44) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL11411368 0.84 DHCR24 (0.50) MEN1KMT2AUSP2ALDH1A1MAPT

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-4202891-A ANOREXIGENIC AGENTS, ANTICHOLESTEROL AGENTS, INHIBITORS OF CELL GROWTH PARISH, EDWARD J. 1980-05-13 — — US disclosed
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