SCHEMBL14501371

SCHEMBL14501371

CC#Cc1cccc(OC(=O)c2cccc(C(=O)Oc3cccc(C#CC)c3)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 3/20 0.50
▸ ESR2 Q92731 2/20 0.50
▸ PRSS1 P07477 3/20 0.47
▸ ACR P10323 3/20 0.47
▸ HAO1 Q9UJM8 1/20 0.46
▸ MAPT P10636 5/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ KMT2A Q03164 4/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ CASP3 P42574 1/20 0.44
▸ SENP8 Q96LD8 1/20 0.44
▸ SENP7 Q9BQF6 1/20 0.44
▸ SENP6 Q9GZR1 1/20 0.44
▸ TDP1 Q9NUW8 2/20 0.43
▸ SERPINE1 P05121 1/20 0.43
▸ POLB P06746 1/20 0.41

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
SCHEMBL14501370 0.95 PRSS1 (0.48) ESR1ESR2PRSS1ACRHAO1
SCHEMBL14501372 0.92 KMT2A (0.51) ESR1ESR2PRSS1ACRHAO1
SCHEMBL28692695 0.81 MEN1 (0.61) PRSS1ACRHAO1CYP3A4KMT2A
SCHEMBL4672150 0.79 ALDH1A1 (0.51) MAPTCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL14501375 0.78 KMT2A (0.53) ESR1ESR2PRSS1ACRMAPT
SCHEMBL4354653 0.78 MAPT (0.52) ESR1ESR2MAPTKMT2AMEN1
SCHEMBL10411916 0.76 MAPT (0.51) ESR1ESR2MAPTKMT2AMEN1
SCHEMBL14501378 0.76 FABP7 (0.51) ESR1ESR2PRSS1ACRHAO1
SCHEMBL13023078 0.76 HAO1 (0.49) ESR1ESR2PRSS1ACRHAO1
SCHEMBL13292713 0.75 ESR1 (0.53) ESR1ESR2PRSS1ACRMAPT

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-7211642-B2 Thermosetting aromatic dielectric material THE BOARD OF TRUSTEES OF THE UNIVERISTY OF ILLINOIS (US) 2007-05-01 — — US disclosed
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