SCHEMBL7671932

SCHEMBL7671932

Cc1ccc(C(=O)NC(C)CC(=O)OC2CCCCC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.48
HPGD P15428 4/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.48
MMP13 P45452 1/20 0.45
PLAU P00749 1/20 0.44
HPN P05981 1/20 0.44
POLB P06746 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CTSL P07711 1/20 0.41
ALDH1A1 P00352 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SSTR3 P32745 1/20 0.40
USP2 O75604 1/20 0.40

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
SCHEMBL7666109 0.89 LMNA (0.47) SMN1; SMN2HPGDNPC1RAB9ACYP1A2
SCHEMBL8424831 0.73 SMN1; SMN2 (0.54) SMN1; SMN2HPGDNPC1RAB9APOLB
SCHEMBL178370 0.72 MEN1 (0.66) SMN1; SMN2HPGDNPC1RAB9ACYP1A2
SCHEMBL6057098 0.72 SCN1A (0.69) SMN1; SMN2HPGDNPC1RAB9ACYP1A2
SCHEMBL6347647 0.71 CYP19A1 (0.68) SMN1; SMN2HPGDNPC1RAB9APOLB
SCHEMBL27182814 0.70 CYP2C19 (0.39) SMN1; SMN2CYP2C19ALDH1A1L3MBTL1
SCHEMBL8424812 0.70 PPARG (0.52) HPGDNPC1RAB9AALDH1A1L3MBTL1
SCHEMBL7697169 0.70 MLYCD (0.46) SMN1; SMN2HPGDNPC1RAB9AMEN1
SCHEMBL7672802 0.70 TDP1 (0.48) SMN1; SMN2HPGDNPC1RAB9AMEN1
SCHEMBL24175853 0.70 ALDH1A1 (0.68) SMN1; SMN2HPGDNPC1RAB9AMEN1

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-6348614-B1 PROTECTING CROPS AGAINST PLANT DISEASES AGROGENE LTD. (IL) 2002-02-19 US claimed
EP-0948481-A1 AMINOBUTYRIC ACID FUNGICIDES Agrogene Ltd. (IL) 1999-10-13 EP claimed
WO-1998029387-A1 AMINOBUTYRIC ACID FUNGICIDES AGROGENE LTD. (IL) 1998-07-09 WO claimed
US-6348614-B1 PROTECTING CROPS AGAINST PLANT DISEASES AGROGENE LTD. (IL) 2002-02-19 US disclosed
EP-0948481-A1 AMINOBUTYRIC ACID FUNGICIDES Agrogene Ltd. (IL) 1999-10-13 EP disclosed
WO-1998029387-A1 AMINOBUTYRIC ACID FUNGICIDES AGROGENE LTD. (IL) 1998-07-09 WO disclosed