SCHEMBL7366644

SCHEMBL7366644

CCCCCCCC([C]=O)C(O)CS

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.41
SPHK1 Q9NYA1 2/20 0.41
FFAR1 O14842 1/20 0.41
MMP3 P08254 1/20 0.40
MAPT P10636 2/20 0.40
CYP2D6 P10635 2/20 0.39
GMNN O75496 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
THPO P40225 1/20 0.39
MTOR P42345 1/20 0.39
BLM P54132 1/20 0.39
KDM4E B2RXH2 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CETP P11597 1/20 0.39
HTT P42858 1/20 0.39
UBE2N P61088 1/20 0.39
SMPD1 P17405 3/20 0.38

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
SCHEMBL10380788 0.86 SPHK1 (0.50) GPR84SPHK1FFAR1MAPTCYP2D6
SCHEMBL10380231 0.86 SPHK1 (0.50) GPR84SPHK1FFAR1MAPTCYP2D6
SCHEMBL7180270 0.85 GPR84 (0.44) GPR84SPHK1FFAR1MAPTCYP2D6
SCHEMBL10436066 0.76 MAPT (0.41) GPR84SPHK1FFAR1MAPTLMNA
SCHEMBL19617794 0.75 ACE2 (0.40) GPR84SPHK1FFAR1MAPTCYP2D6
SCHEMBL7198180 0.75 MAPT (0.39) GPR84SPHK1FFAR1MAPTSMPD1
SCHEMBL18115130 0.75 MAPT (0.39) GPR84SPHK1FFAR1MAPTLMNA
SCHEMBL8411270 0.74 MAPT (0.42) GPR84FFAR1MAPTLMNA
SCHEMBL214294 0.74 MAPT (0.42) GPR84SPHK1FFAR1MAPTLMNA
SCHEMBL7801570 0.74 SPHK1 (0.48) GPR84SPHK1FFAR1MMP3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0832100-A4 NOVEL INHIBITORS OF METALLOPROTEASES, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME AND METHODS OF THEIR USE AFFYMAX TECH NV (AN) 1998-09-02 EP claimed
EP-0832100-A1 NOVEL INHIBITORS OF METALLOPROTEASES, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME AND METHODS OF THEIR USE AFFYMAX TECHNOLOGIES N.V. (AN) 1998-04-01 EP claimed
WO-1996040204-A1 NOVEL INHIBITORS OF COLLAGENASE-1 AND STROMELYSIN-I METALLOPROTEASES, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME AND METHODS OF THEIR USE AFFYMAX TECHNOLOGIES, N.V. (AN) 1996-12-19 WO claimed
WO-1996040738-A1 NOVEL INHIBITORS OF METALLOPROTEASES, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME AND METHODS OF THEIR USE AFFYMAX TECHNOLOGIES, N.V. (AN) 1996-12-19 WO claimed