SCHEMBL4299384

SCHEMBL4299384

CCOc1ccc(C(=O)O)c(Cl)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
POLB P06746 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.43
LMNA P02545 3/20 0.43
MAPK8 P45983 2/20 0.42
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 4/20 0.41
HPGD P15428 3/20 0.41
TSHR P16473 2/20 0.41
HSD17B10 Q99714 2/20 0.41
CYP1A2 P05177 1/20 0.41
P2RX3 P56373 1/20 0.40
GABRP O00591 1/20 0.39
GABRD O14764 1/20 0.39
GABRA1 P14867 1/20 0.39
GABRB1 P18505 1/20 0.39
GABRG2 P18507 1/20 0.39
GABRB3 P28472 1/20 0.39
GABRA5 P31644 1/20 0.39

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
SCHEMBL26150427 0.85 NNMT (0.45) MAPTSMN1; SMN2LMNAMAPK8KDM4E
SCHEMBL5114620 0.84 TDP1 (0.43) MAPTTDP1SMN1; SMN2LMNAMAPK8
SCHEMBL3802758 0.84 ALDH1A1 (0.50) MAPTSMN1; SMN2LMNAKDM4EALDH1A1
SCHEMBL9363634 0.83 MAPT (0.40) MAPTSMN1; SMN2MAPK8KDM4EALDH1A1
SCHEMBL3060488 0.83 PLK1 (0.44) MAPTSMN1; SMN2LMNAMAPK8KDM4E
SCHEMBL1312979 0.81 POLB (0.57) MAPTPOLBTDP1SMN1; SMN2LMNA
SCHEMBL1300585 0.81 TDP1 (0.66) MAPTPOLBTDP1SMN1; SMN2LMNA
SCHEMBL1680784 0.80 MAPT (0.50) MAPTPOLBTDP1SMN1; SMN2LMNA
SCHEMBL31388800 0.80 MCL1 (0.53) POLBSMN1; SMN2LMNAALDH1A1MEN1
SCHEMBL28012425 0.80 SMN1; SMN2 (0.40) POLBTDP1SMN1; SMN2LMNAALDH1A1

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-20090286791-A1 Amide Compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-19 US disclosed
US-20090286791-A1 Amide Compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-19 US disclosed
US-20090286791-A1 Amide Compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-19 US disclosed
US-20080051418-A1 Arylalkanoic Acid Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-02-28 US disclosed
WO-2008011131-A2 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-24 WO disclosed
EP-1829863-A1 ARYLALKANOIC ACID DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2007-09-05 EP 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 (2 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-20090286791-A1 Amide Compounds DLAT, DGAT2, DGAT1 MAPT 1448/4885POLB 2102/4885TDP1 3659/4885
US-20080051418-A1 Arylalkanoic Acid Derivative INSR, NPY1R, GPR119 MAPT 4642/4885POLB 4079/4885TDP1 4792/4885

“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.