Phenyl Propionic Acid

Phenyl Propionic Acid

SCHEMBL3287356

Nc1nc(Nc2ccc(Cl)c(Cl)c2)ncc1C(F)(F)F.O=C(O)CCc1ccccc1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ULK1 O75385 3/20 0.47
SYK P43405 3/20 0.46
GSK3A P49840 2/20 0.43
GSK3B P49841 2/20 0.43
PTK2 Q05397 5/20 0.43
FFAR1 O14842 2/20 0.43
CNR2 P34972 3/20 0.42
AURKA O14965 2/20 0.42
PTK2B Q14289 1/20 0.42
CYP1A2 P05177 1/20 0.42
KDR P35968 1/20 0.41
AURKB Q96GD4 1/20 0.41
KMT2A Q03164 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
SCHEMBL3284065 0.94 ULK1 (0.46) ULK1SYKGSK3AGSK3BPTK2
SCHEMBL3290090 0.89 ULK1 (0.51) ULK1GSK3AGSK3BPTK2CNR2
Butyric Acid SCHEMBL3285798 0.87 ULK1 (0.49) ULK1GSK3AGSK3BPTK2CNR2
SCHEMBL3284056 0.81 SYK (0.50) ULK1SYKPTK2AURKAPTK2B
SCHEMBL3282332 0.80 SYK (0.45) ULK1SYKGSK3AGSK3BPTK2
SCHEMBL3286153 0.79 MRGPRX4 (0.46) ULK1PTK2AURKACYP1A2KDR
SCHEMBL3283769 0.79 ULK1 (0.49) ULK1PTK2AURKAPTK2BKDR
SCHEMBL1917462 0.78 FFAR1 (0.52) SYKGSK3AGSK3BPTK2FFAR1
SCHEMBL3286886 0.77 STK17A (0.54) GSK3AGSK3BPTK2AURKAPTK2B
SCHEMBL1917110 0.76 STK17A (0.58) PTK2PTK2BKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8420630-B2 Pyrimidine derivatives BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2013-04-16 US disclosed
US-20100152167-A1 PYRIMIDINE DERIVATIVES BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2010-06-17 US disclosed
US-7709480-B2 Pyrimidine derivatives BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2010-05-04 US disclosed
US-7173028-B2 Pyrimidine derivatives BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2007-02-06 US disclosed
US-20060100211-A1 Pyrimidine derivatives BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-05-11 US disclosed
US-20030171359-A1 Suitable for treatment of illnesses characterised by excessive or abnormal cell proliferation; viral, bacterial, fungal and/or parasitic infections, skin diseases, bone diseases, cardiovascular diseases BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-09-11 US 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 (3 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-20060100211-A1 Pyrimidine derivatives TYMP, TYMS, DPYD ULK1 1959/4885SYK 2248/4885GSK3A 1259/4885
US-20030171359-A1 Suitable for treatment of illnesses characterised by excessive or abnormal cell proliferation; viral, bacterial, fungal and/or parasitic infections, skin diseases, bone diseases, cardiovascular diseases COL1A1, MKI67, INSR ULK1 3079/4885SYK 918/4885GSK3A 1044/4885
US-20100152167-A1 PYRIMIDINE DERIVATIVES TYMP, TYMS, DPYD ULK1 1959/4885SYK 2248/4885GSK3A 1259/4885

“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.