SCHEMBL15577140

SCHEMBL15577140

CO[C@](Cc1ccc(N)cc1)(C(C)=O)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 2/20 0.40
FDPS P14324 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
HIF1A Q16665 1/20 0.37
PPIB P23284 1/20 0.36
PPIA P62937 1/20 0.36
PPID Q08752 1/20 0.36
PPIG Q13427 1/20 0.36
CYP3A4 P08684 3/20 0.35
CYP1A2 P05177 2/20 0.35
LMNA P02545 2/20 0.35
MAOA P21397 2/20 0.35
CYP19A1 P11511 3/20 0.35
EPHX2 P34913 1/20 0.35
PTPN1 P18031 2/20 0.35
PTPRB P23467 2/20 0.35
PTPN2 P17706 1/20 0.35
PTPRA P18433 1/20 0.35
ALDH1A1 P00352 4/20 0.34
TDP1 Q9NUW8 2/20 0.34

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
SCHEMBL15577125 1.00 BLM (0.40) BLMFDPSSMN1; SMN2HIF1APPIB
SCHEMBL12141665 0.86 ALDH1A1 (0.47) FDPSSMN1; SMN2HIF1ACYP3A4CYP1A2
SCHEMBL20347416 0.78 BLM (0.45) BLMFDPSSMN1; SMN2HIF1APPIB
SCHEMBL934104 0.77 SMN1; SMN2 (0.52) FDPSSMN1; SMN2HIF1ACYP3A4CYP1A2
SCHEMBL20333729 0.77 ITGB1 (0.40) BLMFDPSSMN1; SMN2HIF1APPIB
SCHEMBL20350718 0.76 ALDH1A1 (0.50) SMN1; SMN2HIF1ACYP1A2PTPRBALDH1A1
SCHEMBL20333381 0.76 RXRA (0.39) BLMSMN1; SMN2HIF1ACYP3A4LMNA
SCHEMBL20333384 0.74 SMN1; SMN2 (0.50) SMN1; SMN2PPIDCYP3A4CYP1A2LMNA
SCHEMBL20333769 0.73 FFAR1 (0.50) LMNA
SCHEMBL19953750 0.72 PTPN1 (0.42) EPHX2PTPN1PTPRBPTPN2PTPRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2897603-A1 METHODS OF INHIBITING HAIR GROWTH Nogra Pharma Limited (IE) 2015-07-29 EP claimed
WO-2014041141-A1 METHODS OF INHIBITING HAIR GROWTH NOGRA PHARMA LIMITED (IE) 2014-03-20 WO claimed
WO-2017046343-A1 COMPOSITIONS FOR RECTAL ADMINISTRATION IN THE TREATMENT OF ULCERATIVE COLITIS AND METHODS OF USING SAME NOGRA PHARMA LIMITED (IE) 2017-03-23 WO disclosed