SCHEMBL3211056

SCHEMBL3211056

O=C(O)c1cc(F)cc(-c2ccc(-c3ccccc3)cc2)c1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 4/20 0.62
KMO O15229 1/20 0.55
AXL P30530 1/20 0.55
EGFR P00533 1/20 0.55
BCL2L1 Q07817 1/20 0.53
BAD Q92934 1/20 0.53
HCAR1 Q9BXC0 1/20 0.52
PTGER1 P34995 1/20 0.50
PPARA Q07869 1/20 0.49
CTRC Q99895 1/20 0.47

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
SCHEMBL122522 0.98 DHODH (0.59) DHODHKMOAXLEGFRBCL2L1
SCHEMBL30189265 0.87 KMO (0.53) DHODHKMOAXLHCAR1
SCHEMBL29772042 0.87 HCAR1 (0.60) DHODHEGFRBCL2L1BADHCAR1
SCHEMBL2160048 0.87 KMO (0.53) DHODHKMOAXLHCAR1
SCHEMBL18235913 0.87 DHODH (0.49) DHODHKMOAXLEGFRBCL2L1
SCHEMBL23671728 0.86 DHODH (0.81) DHODHKMOEGFRCTRC
SCHEMBL2559182 0.84 BCL2L1 (0.53) DHODHBCL2L1BADHCAR1PPARA
SCHEMBL4266117 0.83 KMO (0.75) DHODHKMOEGFRCTRC
SCHEMBL1768904 0.83 DHODH (0.77) DHODHKMOEGFRCTRC
SCHEMBL27736451 0.83 DHODH (0.77) DHODHKMOEGFRCTRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7683097-B2 Topoisomerase inhibitors Propharmacon Inc. (US) 2010-03-23 US claimed
US-7683097-B2 Topoisomerase inhibitors Propharmacon Inc. (US) 2010-03-23 US disclosed
US-20070004701-A1 Topoisomerase inhibitors PROPHARMACON, INC. (US) 2007-01-04 US 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-20070004701-A1 Topoisomerase inhibitors TOP1, TOP2A, TOP2B DHODH 534/4885KMO 3110/4885AXL 4734/4885

“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.