SCHEMBL12058560

SCHEMBL12058560

CCCCCCC(CCCCCC)N1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(Cc1ccc(/C=[N+](\C)[O-])cc1)C5=O

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ STAT3 P40763 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ TERT O14746 2/20 0.32
▸ LMNA P02545 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ HDAC3 O15379 1/20 0.30
▸ HDAC1 Q13547 1/20 0.30
▸ HDAC2 Q92769 1/20 0.30
▸ HDAC10 Q969S8 1/20 0.30
▸ HDAC6 Q9UBN7 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30

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
SCHEMBL12058576 0.97 CA12 (0.34) CA12CA1CA2CA9STAT3
SCHEMBL12058557 0.88 MEN1 (0.36) CA12CA1CA2CA9STAT3
SCHEMBL9986058 0.87 CA12 (0.37) CA12CA1CA2CA9STAT3
SCHEMBL12058575 0.85 CA12 (0.35) CA12CA1CA2CA9STAT3
SCHEMBL18379202 0.81 STAT3 (0.41) CA12CA1CA2CA9STAT3
SCHEMBL15108564 0.81 NPSR1 (0.35) CA12CA1CA2CA9STAT3
SCHEMBL15810567 0.79 HIF1A (0.42) STAT3HIF1AMEN1KMT2APOLB
SCHEMBL17190576 0.79 HIF1A (0.42) STAT3HIF1AMEN1KMT2APOLB
SCHEMBL7485582 0.79 HIF1A (0.42) STAT3HIF1AMEN1KMT2APOLB
SCHEMBL22015900 0.79 HIF1A (0.42) STAT3HIF1AMEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9290494-B2 Systems for the light-induced separation of charges CYNORA GMBH (DE) 2016-03-22 — — US disclosed
US-20110318842-A1 SYSTEMS FOR THE LIGHT-INDUCED SEPARATION OF CHARGES LUDWIG-MAXIMILLIANS-UNIVERSITÄT (DE) 2011-12-29 — — 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-20110318842-A1 SYSTEMS FOR THE LIGHT-INDUCED SEPARATION OF CHARGES CRY2, CYBA, CRY1 CA12 1629/4885CA1 2667/4885CA2 856/4885

“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.

Send feedback