SCHEMBL4553578

SCHEMBL4553578

COC(=O)CC1(OC(C)=O)CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.35
GAA P10253 1/20 0.35
SI P14410 1/20 0.35
MGAM2 Q2M2H8 1/20 0.35
CYP3A4 P08684 3/20 0.35
TP53 P04637 1/20 0.34
TSHR P16473 4/20 0.33
ALDH1A1 P00352 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
USP2 O75604 1/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32
BLM P54132 1/20 0.32
CACNA2D1 P54289 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP2C19 P33261 2/20 0.32
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
EPHX2 P34913 1/20 0.31

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
SCHEMBL27650612 0.86 CYP2C19 (0.33) TSHRALDH1A1USP2LMNACYP1A2
SCHEMBL22478769 0.83 ALDH1A1 (0.39) MGAMGAASIMGAM2CYP3A4
SCHEMBL14514434 0.82 TP53 (0.36) MGAMGAASIMGAM2TP53
SCHEMBL10822838 0.82 KDM4E (0.40) MGAMGAASIMGAM2TSHR
SCHEMBL22478783 0.81 ALDH1A1 (0.41) MGAMGAASIMGAM2CYP3A4
SCHEMBL28758873 0.78 NPSR1 (0.32) MGAMGAASIMGAM2CYP3A4
SCHEMBL3692669 0.78 CYP3A4 (0.35) MGAMGAASIMGAM2CYP3A4
SCHEMBL7111915 0.77 TSHR (0.37) GAATSHRALDH1A1NPSR1MEN1
SCHEMBL13649534 0.76 ALDH1A1 (0.32) TSHRALDH1A1LMNACYP2C19HSD17B10
SCHEMBL14883391 0.76 ALDH1A1 (0.32) TSHRALDH1A1LMNACYP2C19HSD17B10

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-2114437-A2 MODIFIED CORTICOTROPIN RELEASING FACTOR PEPTIDES AND USES THEREOF ConjuChem Biotechnologies Inc. (CA) 2009-11-11 EP disclosed
WO-2008047241-A2 MODIFIED CORTICOTROPIN RELEASING FACTOR PEPTIDES AND USES THEREOF CONJUCHEM BIOTECHNOLOGIES INC. (US) 2008-04-24 WO disclosed