SCHEMBL6679276

SCHEMBL6679276

Cn1cc(NC(=O)c2ccccc2N2CCCC2)cc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.56
L3MBTL1 Q9Y468 4/20 0.56
ALDH1A1 P00352 9/20 0.47
POLB P06746 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
KDM4E B2RXH2 1/20 0.47
HPGD P15428 1/20 0.47
ATM Q13315 2/20 0.47
MAPT P10636 7/20 0.46
BRPF1 P55201 5/20 0.46
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
NPSR1 Q6W5P4 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
MAPK1 P28482 2/20 0.44
USP2 O75604 1/20 0.44
GLA P06280 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
BRD4 O60885 2/20 0.44

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
SCHEMBL6673492 0.90 RAB9A (0.52) GAAL3MBTL1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL7041929 0.79 L3MBTL1 (0.50) GAAL3MBTL1ALDH1A1POLBSMN1; SMN2
SCHEMBL7038354 0.79 MEN1 (0.51) GAAALDH1A1POLBSMN1; SMN2KDM4E
SCHEMBL7039846 0.78 CHRNB2 (0.60) GAAL3MBTL1ALDH1A1POLBKDM4E
SCHEMBL6679979 0.75 RAB9A (0.54) L3MBTL1ALDH1A1POLBSMN1; SMN2KDM4E
SCHEMBL31429568 0.75 L3MBTL1 (0.78) GAAL3MBTL1ALDH1A1POLBSMN1; SMN2
SCHEMBL6673884 0.74 L3MBTL1 (0.55) GAAL3MBTL1ALDH1A1POLBKDM4E
SCHEMBL6673493 0.73 RAB9A (0.49) GAAALDH1A1SMN1; SMN2KDM4EHPGD
SCHEMBL18426608 0.73 HTT (0.56) GAAL3MBTL1ALDH1A1POLBSMN1; SMN2
SCHEMBL6675658 0.73 HTT (0.54) GAAL3MBTL1ALDH1A1POLBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1465613-A2 COMBINATION OF MTP INHIBITORS OR APOB SECRETION INHIBITORS WITH FIBRATES FOR USE AS DRUGS Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2004-10-13 EP disclosed
US-20030162788-A1 Combination of MTP inhibitors or apoB-secretion inhibitors with fibrates for use as pharmaceuticals BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-08-28 US disclosed
WO-2003057205-A2 COMBINATION OF MTP INHIBITORS OR APOB SECRETION INHIBITORS WITH FIBRATES FOR USE AS DRUGS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-07-17 WO disclosed
US-20030073836-A1 Heteroarylcarboxylic acid amides, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-04-17 US disclosed
WO-2003004020-A1 HETEROARYL CARBOXYLIC ACID AMIDES, THE PRODUCTION THEREOF AND THE USE OF THE SAME AS INHIBITORS OF THE MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN (MTP) BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-01-16 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 (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-20030162788-A1 Combination of MTP inhibitors or apoB-secretion inhibitors with fibrates for use as pharmaceuticals APOB, LIPC, MTPN GAA 276/4885L3MBTL1 2563/4885ALDH1A1 2713/4885
US-20030073836-A1 Heteroarylcarboxylic acid amides, the preparation thereof and their use as pharmaceutical compositions MTTP, CETP, CES1 GAA 1651/4885L3MBTL1 2996/4885ALDH1A1 756/4885

“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.