SCHEMBL8917566

SCHEMBL8917566

O=C(O)C=CCc1ccc(C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
TP53 P04637 1/20 0.48
TSHR P16473 1/20 0.48
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45
KMT2A Q03164 3/20 0.43
SRD5A2 P31213 3/20 0.43
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
NR4A1 P22736 1/20 0.42
APEX1 P27695 1/20 0.42
APOBEC3A P31941 1/20 0.42
RECQL P46063 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HIF1A Q16665 1/20 0.42

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
SCHEMBL8917564 1.00 ALDH1A1 (0.50) ALDH1A1TP53TSHRCA1CA2
SCHEMBL11366685 0.89 MAOB (0.46) ALDH1A1TP53TSHRCA1CA2
SCHEMBL27926571 0.85 KMT2A (0.53) ALDH1A1KMT2AMAPTTHRBRECQL
SCHEMBL27678556 0.85 ATG4B (0.38) ALDH1A1KMT2AMAPTTHRBRECQL
SCHEMBL27908596 0.85 KMT2A (0.53) ALDH1A1KMT2AMAPTTHRBRECQL
SCHEMBL11219683 0.83 LPAR2 (0.42) ALDH1A1TSHRCA1CA2KDM4E
SCHEMBL11219685 0.83 LPAR2 (0.42) ALDH1A1TSHRCA1CA2KDM4E
SCHEMBL3119857 0.82 CA2 (0.50) ALDH1A1CA1CA2KMT2AGAA
SCHEMBL5576096 0.82 ALDH1A1 (0.52) ALDH1A1TP53TSHRCA1CA2
SCHEMBL5805280 0.82 ALDH1A1 (0.52) ALDH1A1TP53TSHRCA1CA2

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-5691053-A Coating composition with thermally-influenced color DAIMLER-BENZ AG (DE) 1997-11-25 US disclosed