SCHEMBL11118863

SCHEMBL11118863

CCCCCC(=O)OC(O)C(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 11/20 0.74
▸ SMN1; SMN2 Q16637 3/20 0.74
▸ MAPT P10636 2/20 0.74
▸ POLB P06746 1/20 0.74
▸ GAA P10253 1/20 0.74
▸ NR3C2 P08235 5/20 0.66
▸ KMT2A Q03164 2/20 0.63
▸ LMNA P02545 2/20 0.63
▸ NR3C1 P04150 3/20 0.63
▸ PGR P06401 3/20 0.63
▸ CYP2C19 P33261 2/20 0.63
▸ HSD17B10 Q99714 2/20 0.63
▸ SERPINA6 P08185 2/20 0.63
▸ NFKB1 P19838 2/20 0.63
▸ CYP3A4 P08684 2/20 0.63
▸ SHBG P04278 1/20 0.63
▸ AR P10275 1/20 0.61
▸ CHRM1 P11229 1/20 0.61
▸ PMP22 Q01453 1/20 0.59
▸ TSHR P16473 1/20 0.59

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
SCHEMBL9802150 0.99 HIF1A (0.75) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL9699666 0.89 HIF1A (0.63) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL7519660 0.87 HIF1A (0.75) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL5084679 0.86 HIF1A (0.98) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL141851 0.85 HIF1A (1.00) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL7142712 0.85 HIF1A (1.00) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL7137200 0.85 HIF1A (1.00) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL3488312 0.85 HIF1A (1.00) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL16020569 0.84 HIF1A (0.78) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL11814284 0.84 HIF1A (0.81) HIF1ASMN1; SMN2MAPTPOLBGAA

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-4455146-A THERMOPLASTIC ELASTOMERS, OILS OR FATTY ACID, TACKFIER, AND A MEDICINE HISAMITSU PHARMACEUTICAL CO., LTD. (JP) 1984-06-19 — — US disclosed
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