SCHEMBL6906184

SCHEMBL6906184

CCCCOC(=O)NC(C(C)=O)N1CCCC1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
TP53 P04637 1/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
KMT2A Q03164 1/20 0.44
RELA Q04206 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MAPK1 P28482 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ALDH1A1 P00352 3/20 0.41
EPHX1 P07099 1/20 0.39
ACHE P22303 7/20 0.38
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL8303682 0.74 L3MBTL1 (0.54) MAPTSMN1; SMN2NPC1RAB9ATP53
SCHEMBL6906186 0.73 ALDH1A1 (0.47) MAPTSMN1; SMN2NPC1RAB9ATP53
SCHEMBL8382659 0.73 EPHX1 (0.52) SMN1; SMN2NPC1RAB9ANFKB1KMT2A
SCHEMBL4775488 0.73 MAPT (0.44) MAPTSMN1; SMN2NPC1RAB9ATP53
SCHEMBL5128756 0.72 EPHX1 (0.50) SMN1; SMN2NPC1RAB9AL3MBTL1MAPK1
SCHEMBL1383077 0.71 SMN1; SMN2 (0.50) MAPTSMN1; SMN2NPC1RAB9ATP53
SCHEMBL20594028 0.71 L3MBTL1 (0.54) MAPTSMN1; SMN2NPC1RAB9ATP53
SCHEMBL5622460 0.71 EPHX1 (0.48) SMN1; SMN2NPC1RAB9AL3MBTL1MAPK1
SCHEMBL18507224 0.71 EPHX1 (0.48) SMN1; SMN2NPC1RAB9AL3MBTL1MAPK1
SCHEMBL27813025 0.71 EPHX1 (0.48) SMN1; SMN2NPC1RAB9AL3MBTL1MAPK1

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
US-20040023975-A1 Pharmaceutical compositions for the treatment of systemic inflammatory response syndrome BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-02-05 US disclosed
EP-1244636-A1 BENZIMIDAZOLES, PRODUCTION THEREOF AND THE USE THEREOF AS ANTITHROMBOTIC Boehringer Ingelheim Pharma KG (DE) 2002-10-02 EP disclosed
WO-2001047896-A1 BENZIMIDAZOLES, PRODUCTION THEREOF AND THE USE THEREOF AS ANTITHROMBOTIC BOEHRINGER INGELHEIM PHARMA KG (DE) 2001-07-05 WO disclosed
EP-1095025-A2 BENZIMIDAZOLES, PRODUCTION THEREOF AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM KG (DE) 2001-05-02 EP disclosed
WO-2000001704-A2 BENZIMIDAZOLES, PRODUCTION THEREOF AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA KG (DE) 2000-01-13 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-20040023975-A1 Pharmaceutical compositions for the treatment of systemic inflammatory response syndrome IL5, TSLP, TLR5 MAPT 3961/4885SMN1; SMN2 3261/4885NPC1 4352/4885

“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.