SCHEMBL6521072

SCHEMBL6521072

C=C(C(=O)O)C(CC(=O)c1ccc(C)cc1)(C(=O)O)C1CCCCCCC1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.42
NPC1 O15118 6/20 0.42
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 2/20 0.40
CYP1A2 P05177 1/20 0.40
HPGD P15428 1/20 0.40
CYP2C19 P33261 1/20 0.40
ALDH1A1 P00352 1/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 2/20 0.38
HAO1 Q9UJM8 1/20 0.37
POLB P06746 2/20 0.36
GSK3B P49841 1/20 0.36
CYP2J2 P51589 1/20 0.36
MMP13 P45452 1/20 0.36
MAPT P10636 1/20 0.35
TSHR P16473 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
SCHEMBL6519518 1.00 RAB9A (0.42) RAB9ANPC1GAASMN1; SMN2LMNA
SCHEMBL6515201 0.88 KEAP1 (0.41) RAB9AGAASMN1; SMN2HPGDALDH1A1
SCHEMBL6516322 0.87 KEAP1 (0.42) RAB9AGAASMN1; SMN2LMNAHPGD
SCHEMBL6520662 0.84 NPC1 (0.42) RAB9ANPC1SMN1; SMN2LMNAHPGD
SCHEMBL6523076 0.81 KMT2A (0.37) RAB9AGAASMN1; SMN2LMNAHPGD
SCHEMBL6514892 0.74 TET2 (0.32)
SCHEMBL6520539 0.74 PTPN1 (0.43) GAASMN1; SMN2LMNACYP1A2HPGD
SCHEMBL6518777 0.74 NPC1 (0.45) RAB9ANPC1SMN1; SMN2LMNAALDH1A1
SCHEMBL6518888 0.74
SCHEMBL6519403 0.73 CES2 (0.33)

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 RAB9A 2333/4885NPC1 3563/4885GAA 3231/4885

“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.