SCHEMBL7077402

SCHEMBL7077402

CCC(C)c1cccc(C(C)CC)c1Oc1ccc(NC(=O)c2cccc(NC=O)c2O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNLIP P16233 5/20 0.43
NPC1 O15118 5/20 0.42
RAB9A P51151 5/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
TP53 P04637 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
HTT P42858 2/20 0.42
KDM4E B2RXH2 2/20 0.42
LMNA P02545 2/20 0.42
MAPT P10636 3/20 0.39
MAPK1 P28482 3/20 0.39
POLB P06746 1/20 0.38
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
KLK1 P06870 1/20 0.37
KLK5 Q9Y337 1/20 0.37
GFER P55789 1/20 0.37

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
SCHEMBL7078518 0.93 PNLIP (0.41) PNLIPNPC1RAB9AMEN1KMT2A
SCHEMBL8629300 0.89 RXFP1 (0.48) MAPTMAPK1
SCHEMBL7080494 0.81 PNLIP (0.62) PNLIPNPC1RAB9AMEN1KMT2A
SCHEMBL7074399 0.81 PNLIP (0.61) PNLIPMEN1KMT2ALMNAMAPK1
SCHEMBL7073943 0.78 PKM (0.47) PNLIPTP53LMNAMAPK1KLK1
SCHEMBL7074417 0.76 TLR8 (0.49) PNLIPTP53LMNAMAPK1KLK1
SCHEMBL1457071 0.74 RXFP1 (0.56) MEN1KMT2ATP53HTTKDM4E
SCHEMBL5584053 0.73 KDM4E (0.47) PNLIPNPC1RAB9AMEN1KMT2A
SCHEMBL7077257 0.73 RXFP1 (0.60)
SCHEMBL7160758 0.72 SMO (0.52) MEN1KMT2ATP53HTTKDM4E

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
EP-0848700-B1 ACYLAMINOSALICYLIC ACID AMIDES AND THEIR USES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2003-07-02 EP claimed
EP-0848700-B1 ACYLAMINOSALICYLIC ACID AMIDES AND THEIR USES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2003-07-02 EP disclosed
US-6548549-B1 Fungicides, insecticides, bactericides; applying to plant BAYER AKTIENGESELLSCHAFT (DE) 2003-04-15 US disclosed
US-6001879-A SUITABLE FOR CONTROLLING PESTS, PREFERABLY FUNGI, INSECTS AND BACTERIA, IN PLANTS AND INDUSTRIAL MATERIALS; METHODS OF THEIR SYBNTHESIS INCLUDING REACTING AMINOSALICYLAMIDES WITH ACYLATING AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1999-12-14 US disclosed
EP-0848700-A1 ACYLAMINOSALICYLIC ACID AMIDES AND THEIR USES AS PESTICIDES BAYER AG (DE) 1998-06-24 EP disclosed
WO-1997008135-A1 ACYLAMINOSALICYLIC ACID AMIDES AND THEIR USES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-03-06 WO disclosed