SCHEMBL3082998

SCHEMBL3082998

C[C@](N)(CO)CCc1ccc(C(=O)CCCCc2ccccc2)s1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.46
POLB P06746 1/20 0.46
DAGLA Q9Y4D2 2/20 0.42
RXFP1 Q9HBX9 2/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
PRNP P04156 1/20 0.42
RECQL P46063 1/20 0.42
FAAH O00519 7/20 0.42
CES1 P23141 5/20 0.41
DPP4 P27487 1/20 0.41
MAPT P10636 1/20 0.40
ACHE P22303 1/20 0.40
SGMS1 Q86VZ5 1/20 0.40
SGMS2 Q8NHU3 1/20 0.40
PLA2G4A P47712 1/20 0.40
NPC1 O15118 1/20 0.40
CASP3 P42574 1/20 0.40
RAB9A P51151 1/20 0.40
SENP8 Q96LD8 1/20 0.40

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
SCHEMBL383586 1.00 TDP1 (0.46) TDP1POLBDAGLARXFP1ALDH1A1
Hydrochloric Acid SCHEMBL5170441 0.99 TDP1 (0.45) TDP1POLBDAGLARXFP1ALDH1A1
SCHEMBL5166341 0.99 POLB (0.48) TDP1POLBDAGLARXFP1ALDH1A1
SCHEMBL385258 0.96 TDP1 (0.43) TDP1POLBDAGLARXFP1ALDH1A1
Maleic Acid SCHEMBL383976 0.95 POLB (0.42) TDP1POLBDAGLARXFP1ALDH1A1
Fumaric Acid SCHEMBL383978 0.95 POLB (0.42) TDP1POLBDAGLARXFP1ALDH1A1
SCHEMBL5169197 0.90 POLB (0.45) TDP1POLBRXFP1ALDH1A1LMNA
SCHEMBL5167470 0.90 POLB (0.43) TDP1POLBRXFP1ALDH1A1LMNA
SCHEMBL6765320 0.89 TDP1 (0.49) TDP1POLBDAGLARXFP1ALDH1A1
SCHEMBL6774680 0.89 POLB (0.44) TDP1POLBDAGLARXFP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2045325-B1 DRUG-PHOSPHORYLATING ENZYME DAIICHI SANKYO CO LTD (JP) 2012-09-19 EP claimed
US-20100248227-A1 DRUG-PHOSPHORYLATING ENZYME DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-09-30 US claimed
US-20100081702-A1 PHARMACEUTICAL COMPOSITION FOR PROPHYLAXIS OR TREATMENT OF HEPATITIS DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-04-01 US claimed
EP-2149549-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF HEPATITIS Daiichi Sankyo Company, Limited (JP) 2010-02-03 EP claimed
EP-2045325-A1 DRUG-PHOSPHORYLATING ENZYME Daiichi Sankyo Company, Limited (JP) 2009-04-08 EP claimed
EP-2045325-B1 DRUG-PHOSPHORYLATING ENZYME DAIICHI SANKYO CO LTD (JP) 2012-09-19 EP disclosed
EP-2045325-B1 DRUG-PHOSPHORYLATING ENZYME DAIICHI SANKYO CO LTD (JP) 2012-09-19 EP disclosed
US-20100248227-A1 DRUG-PHOSPHORYLATING ENZYME DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-09-30 US disclosed
US-20100248227-A1 DRUG-PHOSPHORYLATING ENZYME DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-09-30 US disclosed
US-20100248227-A1 DRUG-PHOSPHORYLATING ENZYME DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-09-30 US disclosed
US-20100248227-A1 DRUG-PHOSPHORYLATING ENZYME DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-09-30 US disclosed
US-20100081702-A1 PHARMACEUTICAL COMPOSITION FOR PROPHYLAXIS OR TREATMENT OF HEPATITIS DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-04-01 US disclosed
US-20100081702-A1 PHARMACEUTICAL COMPOSITION FOR PROPHYLAXIS OR TREATMENT OF HEPATITIS DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-04-01 US disclosed
US-20100081702-A1 PHARMACEUTICAL COMPOSITION FOR PROPHYLAXIS OR TREATMENT OF HEPATITIS DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-04-01 US disclosed
EP-2149549-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF HEPATITIS Daiichi Sankyo Company, Limited (JP) 2010-02-03 EP disclosed
EP-2149549-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF HEPATITIS Daiichi Sankyo Company, Limited (JP) 2010-02-03 EP disclosed
EP-2045325-A1 DRUG-PHOSPHORYLATING ENZYME Daiichi Sankyo Company, Limited (JP) 2009-04-08 EP disclosed
EP-2045325-A1 DRUG-PHOSPHORYLATING ENZYME Daiichi Sankyo Company, Limited (JP) 2009-04-08 EP disclosed
EP-2045325-A1 DRUG-PHOSPHORYLATING ENZYME Daiichi Sankyo Company, Limited (JP) 2009-04-08 EP disclosed
WO-2008016133-A1 DRUG-PHOSPHORYLATING ENZYME DAIICHI SANKYO COMPANY, LIMITED (JP) 2008-02-07 WO 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-20100081702-A1 PHARMACEUTICAL COMPOSITION FOR PROPHYLAXIS OR TREATMENT OF HEPATITIS SLC10A1, C1S, C1R TDP1 4093/4885POLB 1843/4885DAGLA 4282/4885

“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.