SCHEMBL4840290

SCHEMBL4840290

N#Cc1cccc(CCCC(=O)O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.60
FFAR4 Q5NUL3 2/20 0.60
HDAC3 O15379 1/20 0.58
MAPK1 P28482 1/20 0.58
ADRA1A P35348 1/20 0.58
HDAC4 P56524 1/20 0.58
SLC6A3 Q01959 1/20 0.58
HDAC1 Q13547 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
HDAC7 Q8WUI4 1/20 0.58
HDAC2 Q92769 1/20 0.58
HDAC10 Q969S8 1/20 0.58
HDAC11 Q96DB2 1/20 0.58
HDAC8 Q9BY41 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
HDAC9 Q9UKV0 1/20 0.58
HDAC5 Q9UQL6 1/20 0.58
PTGFR P43088 1/20 0.54
CYP1A2 P05177 2/20 0.51
MAPT P10636 1/20 0.50

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
SCHEMBL3491515 0.90 FFAR1 (0.72) FFAR1FFAR4PTGFRLMNACNR1
SCHEMBL12500258 0.87 FFAR1 (0.50) FFAR1FFAR4PTGFRFOLH1HTR2B
SCHEMBL19062339 0.86 FFAR1 (0.49) FFAR1FFAR4PTGFRFOLH1HTR2B
SCHEMBL25342051 0.82 HDAC3 (0.76) FFAR1HDAC3MAPK1ADRA1AHDAC4
SCHEMBL28248372 0.82 HTR2B (0.54) FFAR1FFAR4FOLH1HTR2BCNR1
SCHEMBL28865565 0.82 HTR2B (0.50) FFAR1FFAR4FOLH1HTR2BCNR1
SCHEMBL27718564 0.82 GLA (0.49) FFAR1FFAR4FOLH1HTR2BLMNA
SCHEMBL1246091 0.82 FFAR1 (0.59) FFAR1FFAR4SMN1; SMN2PTGFRFOLH1
SCHEMBL7335965 0.81 FFAR1 (0.57) FFAR1FFAR4FOLH1HTR2BLMNA
SCHEMBL6962952 0.81 DRD2 (0.49) FFAR1FFAR4FOLH1HTR2BLMNA

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 30 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
CN-109415330-A Novel difluoro keto acyl amine derivative as HTRA1 inhibitor 豪夫迈·罗氏有限公司 2019-03-01 CN 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-3197477-A1 PEPTIDOMIMETIC MACROCYCLES AND FORMULATIONS THEREOF Aileron Therapeutics, Inc. (US) 2017-08-02 EP disclosed
EP-3197478-A1 PEPTIDOMIMETIC MACROCYCLES AND USES THEREOF Aileron Therapeutics, Inc. (US) 2017-08-02 EP 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
US-20130065259-A1 METHODS FOR DETECTION OF BOTULINUM NEUROTOXIN CITY OF HOPE (US) 2013-03-14 US disclosed
WO-2012173846-A2 PEPTIDOMIMETIC MACROCYCLES AILERON THERAPEUTICS, INC. (US) 2012-12-20 WO disclosed
US-7465811-B2 Indoline compounds LABORATOIRES FOURNIER S.A. (FR) 2008-12-16 US disclosed
US-20080119465-A1 Novel Indoline Compounds LABORATORIES FOURNIER S.A. (FR) 2008-05-22 US disclosed
US-5591769-A PYRROLIDINE DERIVATIVES; ANTICOAGULANTS KARL THOMAE GMBH (DE) 1997-01-07 US disclosed
US-5541343-A ANTIAGGLOMERANTS FOR CELLS OR ANTICOAGULANTS KARL THOMAE GMBH (DE) 1996-07-30 US disclosed
CN-1004351-B Method for preparing selaginellin related compound with phenylene 微生物化学研究会 1989-05-31 CN disclosed
CN-85101425-A Have Si Baige Eyring allied compound of phenylene and preparation method thereof 1987-01-17 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080119465-A1 Novel Indoline Compounds GPR119, INSR, IRS1 FFAR1 55/4885FFAR4 125/4885HDAC3 115/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.