SCHEMBL3205541

SCHEMBL3205541

COc1ccc(C(=O)O)cc1-c1ccc(-c2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.59
CA12 O43570 1/20 0.59
CA1 P00915 1/20 0.59
CA2 P00918 1/20 0.59
CA4 P22748 1/20 0.59
CA6 P23280 1/20 0.59
CA7 P43166 1/20 0.59
TPMT P51580 1/20 0.59
CA9 Q16790 1/20 0.59
CA14 Q9ULX7 1/20 0.59
LTB4R Q15722 4/20 0.58
TTR P02766 1/20 0.56
TDP1 Q9NUW8 1/20 0.55
EGFR P00533 1/20 0.55
HTT P42858 2/20 0.54
MAPK1 P28482 1/20 0.54
RAB9A P51151 1/20 0.54
PDE4A P27815 2/20 0.53
PDE4B Q07343 2/20 0.53
PDE4C Q08493 2/20 0.53

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
SCHEMBL402416 0.97 CA12 (0.62) LMNACA12CA1CA2CA4
SCHEMBL6248649 0.87 LMNA (0.59) LMNACA12CA1CA2CA4
SCHEMBL6248458 0.87 LMNA (0.68) LMNACA12CA1CA2CA4
SCHEMBL1406821 0.87 LMNA (0.56) LMNACA12CA1CA2CA4
SCHEMBL30791351 0.86 MRGPRX4 (0.58) LMNACA12CA1CA2CA4
SCHEMBL21941831 0.86 LMNA (0.57) LMNACA12CA1CA2CA4
SCHEMBL6246591 0.86 LMNA (0.57) LMNACA12CA1CA2CA4
SCHEMBL7681150 0.86 LTB4R (0.56) LMNACA12CA1CA2CA4
SCHEMBL9524595 0.85 SYK (0.63) LMNA
SCHEMBL6244003 0.85 CA12 (0.71) LMNACA12CA1CA2CA4

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 LMNA 1934/4885CA12 3701/4885CA1 3574/4885

“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.