Propiolic Acid

Propiolic Acid

SCHEMBL17554270

C#CC(=O)O.C#CCc1ccccc1

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
AKR1B1 P15121 1/20 0.43
KEAP1 Q14145 1/20 0.40
FFAR1 O14842 2/20 0.40
FFAR4 Q5NUL3 1/20 0.40
CYP1A2 P05177 1/20 0.39
NPC1 O15118 2/20 0.38
LMNA P02545 2/20 0.38
TSHR P16473 2/20 0.38
USP2 O75604 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
PYCR1 P32322 1/20 0.38
RAB9A P51151 1/20 0.38
HDAC8 Q9BY41 2/20 0.38
HDAC6 Q9UBN7 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 2/20 0.38

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
Bicarbonate SCHEMBL27692050 0.91 CES2 (0.46) CES2CES1AKR1B1KEAP1FFAR1
SCHEMBL4243 0.86
SCHEMBL29184894 0.84 TSHR (0.45) CYP1A2LMNATSHRUSP2CYP3A4
SCHEMBL28385336 0.84 TSHR (0.45) CYP1A2LMNATSHRUSP2CYP3A4
SCHEMBL16569812 0.79 PYCR1 (0.46) CYP1A2LMNATSHRUSP2CYP3A4
Phosphoramidic Acid SCHEMBL19285697 0.79 LAP3 (0.44) TSHR
Benzylamine SCHEMBL27714907 0.78 LOXL2 (0.61) CES2CES1AKR1B1KEAP1CYP1A2
Ethylbenzene SCHEMBL29123750 0.78 TP53 (0.61) CES2CES1AKR1B1KEAP1LMNA
SCHEMBL7194213 0.78 ALDH1A1 (0.54) CES2CES1NPC1LMNARAB9A
Allyl Alcohol SCHEMBL11726889 0.75 TSHR (0.39) CYP1A2LMNATSHRUSP2CYP3A4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2992947-B1 METHOD FOR THE PREPARATION OF MICROPOROUS ORGANIC MEMBRANES, MICROPOROUS ORGANIC MEMBRANES AND USE OF SAME KARLSRUHER INST TECHNOLOGIE (DE) 2023-03-01 EP disclosed
EP-2992947-A1 METHOD FOR THE PREPARATION OF MICROPOROUS ORGANIC MEMBRANES, MICROPOROUS ORGANIC MEMBRANES AND USE OF SAME Karlsruher Institut für Technologie (DE) 2016-03-09 EP disclosed