SCHEMBL9157035

SCHEMBL9157035

Cc1cccc(CNCCOCCOc2ccc(C(C)(C)CC(C)(C)C)cc2)c1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 5/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ LMNA P02545 4/20 0.47
▸ HIF1A Q16665 4/20 0.47
▸ KMT2A Q03164 4/20 0.47
▸ CYP3A4 P08684 3/20 0.47
▸ TDP1 Q9NUW8 3/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ APAF1 O14727 3/20 0.47
▸ USP2 O75604 3/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ TP53 P04637 3/20 0.47
▸ MAPT P10636 3/20 0.47
▸ RAD52 P43351 3/20 0.47
▸ ERBB2 P04626 2/20 0.47
▸ FYN P06241 2/20 0.47
▸ CHRM2 P08172 2/20 0.47
▸ CHRM4 P08173 2/20 0.47
▸ CHRM5 P08912 2/20 0.47
▸ ADRA2A P08913 2/20 0.47

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
SCHEMBL19074259 0.81 LMNA (0.63) TSHRSMN1; SMN2LMNAHIF1AKMT2A
Hydrochloric Acid SCHEMBL2761472 0.80 LMNA (0.61) TSHRSMN1; SMN2LMNAHIF1AKMT2A
Hydrochloric Acid SCHEMBL426560 0.74 KMT2A (0.60) TSHRSMN1; SMN2LMNAHIF1AKMT2A
Hydrochloric Acid SCHEMBL19461035 0.72 SMN1; SMN2 (0.52) TSHRSMN1; SMN2LMNAHIF1AKMT2A
Hydrochloric Acid SCHEMBL29999168 0.72 KMT2A (0.65) TSHRSMN1; SMN2LMNAHIF1AKMT2A
SCHEMBL4314095 0.71 CYP3A4 (0.64) TSHRSMN1; SMN2LMNAHIF1AKMT2A
SCHEMBL26132824 0.71 CYP3A4 (0.64) TSHRSMN1; SMN2LMNAHIF1AKMT2A
SCHEMBL13932431 0.71 CYP3A4 (0.64) TSHRSMN1; SMN2LMNAHIF1AKMT2A
SCHEMBL10037912 0.71 SMN1; SMN2 (0.64) TSHRSMN1; SMN2LMNAHIF1AKMT2A
SCHEMBL9632628 0.70 SMN1; SMN2 (0.62) TSHRSMN1; SMN2LMNAHIF1AKMT2A

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
EP-0288280-B1 Production of proteins in active forms SOUTHERN CROSS BIOTECH PTY LTD (AU) 1995-03-08 — — EP claimed
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