SCHEMBL6983208

SCHEMBL6983208

O=C1NCCCCCC1I

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 11/20 0.46
HTT P42858 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
FKBP5 Q13451 1/20 0.37
CRBN Q96SW2 1/20 0.37
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL25811036 0.90
SCHEMBL16130005 0.82
SCHEMBL16130006 0.82
SCHEMBL8789059 0.82
SCHEMBL14169742 0.74 KMT2A (0.46) CCR2HTTL3MBTL1FKBP5CRBN
SCHEMBL15132456 0.74 CCR2 (0.44) CCR2HTTL3MBTL1ALDH1A1KDM4E
SCHEMBL18994572 0.74 KMT2A (0.46) CCR2HTTL3MBTL1FKBP5CRBN
SCHEMBL6978411 0.74 CCR2 (0.44) CCR2HTTL3MBTL1ALDH1A1KDM4E
SCHEMBL10896198 0.74 CCR2 (0.44) CCR2HTTL3MBTL1FKBP5CRBN
SCHEMBL10914489 0.74 CCR2 (0.44) CCR2HTTL3MBTL1FKBP5CRBN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6544981-B2 Anticoagulants, cardiovascular disorders BRISTOL-MYERS SQUIBB COMPANY 2003-04-08 US disclosed
EP-1294716-A1 LACTAM INHIBITORS OF FACTOR XA AND METHOD Bristol-Myers Squibb Company (US) 2003-03-26 EP disclosed
US-20020025957-A1 Lactam inhibitors of factor Xa and method BRISTOL-MYERS SQUIBB COMPANY 2002-02-28 US disclosed
WO-2001096331-A1 LACTAM INHIBITORS OF FACTOR XA AND METHOD BRISTOL-MYERS SQUIBB COMPANY (US) 2001-12-20 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-20020025957-A1 Lactam inhibitors of factor Xa and method F9, F7, F11 CCR2 2489/4885HTT 4829/4885L3MBTL1 1775/4885

“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.