SCHEMBL7906876

SCHEMBL7906876

N#Cc1ccccc1CCCC(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 10/20 0.56
HDAC3 O15379 1/20 0.52
MAPK1 P28482 1/20 0.52
ADRA1A P35348 1/20 0.52
HDAC4 P56524 1/20 0.52
SLC6A3 Q01959 1/20 0.52
HDAC1 Q13547 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HDAC7 Q8WUI4 1/20 0.52
HDAC2 Q92769 1/20 0.52
HDAC10 Q969S8 1/20 0.52
HDAC11 Q96DB2 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
HDAC9 Q9UKV0 1/20 0.52
HDAC5 Q9UQL6 1/20 0.52
FFAR4 Q5NUL3 3/20 0.46
MAPT P10636 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL7367036 0.95 FFAR1 (0.55) FFAR1HDAC3MAPK1ADRA1AHDAC4
SCHEMBL30740885 0.89 FFAR1 (0.62) FFAR1FFAR4TSPODRD3PTGER1
SCHEMBL447652 0.89 FFAR1 (0.62) FFAR1FFAR4TSPODRD3PTGER1
SCHEMBL29045424 0.86 FFAR1 (0.46) FFAR1SMN1; SMN2FFAR4MAPTALDH1A1
Phenyl Propionic Acid SCHEMBL5407020 0.83 FFAR1 (0.68) FFAR1HDAC3MAPK1ADRA1AHDAC4
SCHEMBL28248440 0.81 CYP19A1 (0.46) FFAR1SMN1; SMN2MAPTALDH1A1CYP1A2
SCHEMBL28248935 0.81 CYP19A1 (0.46) FFAR1SMN1; SMN2MAPTALDH1A1CYP1A2
SCHEMBL31512109 0.81 HDAC3 (0.68) FFAR1HDAC3MAPK1ADRA1AHDAC4
SCHEMBL2878880 0.81 HDAC3 (0.68) FFAR1HDAC3MAPK1ADRA1AHDAC4
SCHEMBL4837680 0.81 TSHR (0.53) FFAR1MAPTALDH1A1

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3769776-A1 PEPTIDOMIMETIC MACROCYCLES Aileron Therapeutics, Inc. (US) 2021-01-27 EP disclosed
EP-2822572-B1 PEPTIDOMIMETIC MACROCYCLES AILERON THERAPEUTICS INC (US) 2020-06-10 EP disclosed
EP-3432904-A2 COMPANION DIAGNOSTIC TOOL FOR PEPTIDOMIMETIC MACROCYCLES Aileron Therapeutics, Inc. (US) 2019-01-30 EP disclosed
WO-2018165575-A2 WARHEAD-CONTAINING PEPTIDOMIMETIC MACROCYCLES AS MODULATORS OF BFL-1 AILERON THERAPEUTICS, INC. (US) 2018-09-13 WO disclosed
EP-3347372-A1 PEPTIDOMIMETIC MACROCYCLES AS MODULATORS OF MCL-1 Aileron Therapeutics, Inc. (US) 2018-07-18 EP disclosed
EP-3294318-A1 PEPTIDOMIMETIC MACROCYCLES AND USES THEREOF Aileron Therapeutics, Inc. (US) 2018-03-21 EP disclosed
WO-2017165299-A2 COMPANION DIAGNOSTIC TOOL FOR PEPTIDOMIMETIC MACROCYCLES AILERON THERAPEUTICS, INC. (US) 2017-09-28 WO disclosed
EP-3197478-A1 PEPTIDOMIMETIC MACROCYCLES AND USES THEREOF Aileron Therapeutics, Inc. (US) 2017-08-02 EP disclosed
EP-3197477-A1 PEPTIDOMIMETIC MACROCYCLES AND FORMULATIONS THEREOF Aileron Therapeutics, Inc. (US) 2017-08-02 EP disclosed
WO-2017044633-A1 PEPTIDOMIMETIC MACROCYCLES AS MODULATORS OF MCL-1 AILERON THERAPEUTICS, INC. (US) 2017-03-16 WO disclosed
WO-2016049359-A1 PEPTIDOMIMETIC MACROCYCLES AND USES THEREOF AILERON THERAPEUTICS, INC. (US) 2016-03-31 WO disclosed
EP-2822572-A1 PEPTIDOMIMETIC MACROCYCLES Aileron Therapeutics, Inc. (US) 2015-01-14 EP disclosed
EP-2819688-A1 TRIAZOLE-CROSSLINKED AND THIOETHER-CROSSLINKED PEPTIDOMIMETIC MACROCYCLES Aileron Therapeutics, Inc. (US) 2015-01-07 EP disclosed
WO-2014138429-A2 PEPTIDOMIMETIC MACROCYCLES AND USE THEREOF IN REGULATING HIF1ALPHA AILERON THERAPEUTICS, INC. (US) 2014-09-12 WO disclosed
EP-2768518-A1 PEPTIDOMIMETIC MACROCYLES Aileron Therapeutics, Inc. (US) 2014-08-27 EP disclosed
WO-2013123267-A1 TRIAZOLE-CROSSLINKED AND THIOETHER-CROSSLINKED PEPTIDOMIMETIC MACROCYCLES AILERON THERAPEUTICS, INC. (US) 2013-08-22 WO disclosed
WO-2013123266-A1 PEPTIDOMIMETIC MACROCYCLES AILERON THERAPEUTICS, INC. (US) 2013-08-22 WO disclosed
WO-2013059525-A1 PEPTIDOMIMETIC MACROCYLES AILERON THERAPEUTICS, INC. (US) 2013-04-25 WO disclosed
WO-2012173846-A2 PEPTIDOMIMETIC MACROCYCLES AILERON THERAPEUTICS, INC. (US) 2012-12-20 WO disclosed
US-6190841-B1 ACID GENERATOR WHICH GENERATES AN ACID WHEN IRRADIATED WITH ACTINIC RADIATION, AND COMPOUND CONTAINING CARBOXYL GROUPS, WHICH CAN DECOMPOSE UPON DECARBOXYLATION KABUSHIKI KAISHA TOSHIBA (JP) 2001-02-20 US disclosed