SCHEMBL3293599

SCHEMBL3293599

CCN(CC)CCN1C(=O)c2ccc3c4cccc5c(Br)ccc(c6ccc(c2c36)C1=O)c54

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.58
▸ MEN1 O00255 2/20 0.58
▸ KMT2A Q03164 2/20 0.58
▸ ALDH1A1 P00352 2/20 0.58
▸ KDM4E B2RXH2 1/20 0.58
▸ NPC1 O15118 1/20 0.58
▸ LMNA P02545 1/20 0.58
▸ MAPT P10636 1/20 0.58
▸ PABPC1 P11940 1/20 0.58
▸ CYP1B1 Q16678 12/20 0.56
▸ TERT O14746 2/20 0.56
▸ STAT3 P40763 1/20 0.50
▸ HIF1A Q16665 1/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ TNNI3 P19429 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ STAT6 P42226 1/20 0.50
▸ TNNT2 P45379 1/20 0.50
▸ TNNC1 P63316 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50

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
SCHEMBL12127001 0.87 TERT (0.71) POLBMEN1KMT2AALDH1A1KDM4E
SCHEMBL30272534 0.86 TERT (0.59) POLBMEN1KMT2AALDH1A1KDM4E
SCHEMBL12225934 0.83 TERT (0.66) POLBMEN1KMT2AALDH1A1KDM4E
SCHEMBL7648035 0.81 POLB (0.59) POLBMEN1KMT2AALDH1A1KDM4E
SCHEMBL21988071 0.81 POLB (0.59) POLBMEN1KMT2AALDH1A1KDM4E
SCHEMBL24401821 0.79 STAT3 (0.73) POLBMEN1KMT2AALDH1A1KDM4E
SCHEMBL12869513 0.79 CYP1B1 (0.55) POLBMEN1KMT2AALDH1A1KDM4E
SCHEMBL12133952 0.78 POLB (0.85) POLBMEN1KMT2AALDH1A1KDM4E
SCHEMBL1105127 0.77 TERT (0.69) POLBMEN1KMT2AALDH1A1KDM4E
SCHEMBL20419197 0.76 CYP1B1 (0.78) POLBMEN1KMT2AALDH1A1KDM4E

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-7741487-B2 Method for producing quaterrylene-3,4:13, 14-tetracarboxy diimides by direct synthesis BASF AKTIENGESELLSCHAFT (DE) 2010-06-22 — — US disclosed
US-20090030206-A1 METHOD FOR PRODUCING QUATERRYLENE-3,4:13, 14-TETRACARBOXY DIIMIDES BY DIRECT SYNTHESIS BASF AKTIENGESELLSCHAFT (DE) 2009-01-29 — — 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-20090030206-A1 METHOD FOR PRODUCING QUATERRYLENE-3,4:13, 14-TETRACARBOXY DIIMIDES BY DIRECT SYNTHESIS CDY1; CDY1B, C9, HACL2 POLB 1276/4885MEN1 851/4885KMT2A 807/4885

“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.

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