SCHEMBL6515501

SCHEMBL6515501

C=C(C(=O)O)C(CC(=O)c1cccc(C)c1)(C(=O)O)c1cccc(C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
ACHE P22303 1/20 0.40
POLB P06746 1/20 0.40
PARP1 P09874 1/20 0.39
CTNNB1 P35222 3/20 0.39
WNT3A P56704 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
KIF11 P52732 3/20 0.36
KCNK3 O14649 1/20 0.36
KCNK9 Q9NPC2 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL6519096 0.95 SMN1; SMN2 (0.41) HPGDTDP1POLBPARP1CTNNB1
SCHEMBL6522215 0.81 MAPT (0.41) HPGDTDP1POLBSMN1; SMN2KDM4E
SCHEMBL6519557 0.80 KMT2A (0.47) HPGDTDP1POLBSMN1; SMN2KDM4E
SCHEMBL6514450 0.80 NPC1 (0.47) TDP1POLBSMN1; SMN2HDAC8HDAC6
SCHEMBL6519409 0.80 HPGD (0.43) HPGDTDP1POLBPARP1CTNNB1
SCHEMBL6515893 0.77 NPC1 (0.46) POLBSMN1; SMN2MEN1LMNAMAPT
SCHEMBL6514658 0.76 RAB9A (0.43) HPGDTDP1POLBPARP1CTNNB1
SCHEMBL6520662 0.74 NPC1 (0.42) HPGDTDP1POLBPARP1CTNNB1
SCHEMBL6519182 0.74 CTNNB1 (0.41) HPGDTDP1POLBPARP1CTNNB1
SCHEMBL6520254 0.70 CYP2C19 (0.41) HPGDPOLBSMN1; SMN2HDAC8HDAC6

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
US-6958366-B2 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-10-25 US disclosed
US-20030118544-A1 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-06-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030118544-A1 Antifouling coating composition and novel resin COL1A1, GLRA1, COL2A1 HPGD 4110/4885TDP1 1789/4885ACHE 3166/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.