SCHEMBL7967762

SCHEMBL7967762

CCOC(=O)/C(Cl)=C/c1cc(NC(=O)C2=C(C(N)=O)CCCC2)ccc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.39
KMT2A Q03164 2/20 0.36
MAPT P10636 6/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
LMNA P02545 1/20 0.36
ALDH1A1 P00352 2/20 0.35
HPGD P15428 1/20 0.35
PARP1 P09874 1/20 0.35
PARP15 Q460N3 1/20 0.35
PARP10 Q53GL7 1/20 0.35
DHODH Q02127 3/20 0.34
MAPK1 P28482 2/20 0.34
KDM4E B2RXH2 1/20 0.34
USP2 O75604 1/20 0.34
TSHR P16473 1/20 0.34
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
TP53 P04637 1/20 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
SCHEMBL7762961 1.00 NPSR1 (0.39) NPSR1KMT2AMAPTSMN1; SMN2NPC1
SCHEMBL8304677 0.91 NPSR1 (0.50) NPSR1KMT2ALMNAPARP1PARP15
SCHEMBL7767725 0.88 KMT2A (0.39) NPSR1KMT2AMAPTSMN1; SMN2NPC1
SCHEMBL7931184 0.84 KMT2A (0.42) KMT2AMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL7931186 0.84 KMT2A (0.42) KMT2AMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL7933665 0.81 DGAT1 (0.48) KMT2AMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL7933664 0.81 DGAT1 (0.48) KMT2AMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL7964432 0.81 NPSR1 (0.41) NPSR1MAPTRAB9ALMNAPARP1
SCHEMBL7964429 0.81 NPSR1 (0.41) NPSR1MAPTRAB9ALMNAPARP1
SCHEMBL7017572 0.79 MAPT (0.41) NPSR1KMT2AMAPTSMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6204222-B1 SUITABLE AS HERBICIDES AND FOR DESICCATION/DEFOLIATION OF PLANTS BASF AKTIENGESELLSCHAFT (DE) 2001-03-20 US disclosed