SCHEMBL14599677

SCHEMBL14599677

CCCCCCCCCCCCCCCCOc1ccc(-c2c3nc(c(C#Cc4ccccn4)c4ccc([nH]4)c(C#Cc4ccccn4)c4nc(c(-c5ccccc5)c5ccc2s5)C=C4)C=C3)cc1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ CYP2D6 P10635 2/20 0.36
▸ CYP19A1 P11511 2/20 0.36
▸ CYP2C9 P11712 2/20 0.36
▸ CYP2C19 P33261 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ ATP4A P20648 11/20 0.33
▸ ATP4B P51164 11/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ LTA4H P09960 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ RARB P10826 2/20 0.31

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
SCHEMBL14599679 0.82 STAT3 (0.39) L3MBTL1TDP1
SCHEMBL14599678 0.82 ATP4A (0.38) L3MBTL1CYP2D6CYP19A1CYP2C9CYP2C19
SCHEMBL14599686 0.79 TDP1 (0.36) L3MBTL1TDP1
SCHEMBL14599698 0.77 FFAR1 (0.39) L3MBTL1TDP1
SCHEMBL14599706 0.77 STAT3 (0.38) L3MBTL1ATP4AATP4BKDM4ENPC1
SCHEMBL14629725 0.76 TDP1 (0.34) L3MBTL1TDP1
SCHEMBL14599676 0.75 STAT3 (0.44) L3MBTL1ATP4AATP4BKDM4ENPC1
Pyridine SCHEMBL28010654 0.74 CYP2D6 (0.49) L3MBTL1CYP2D6CYP19A1CYP2C9CYP2C19
SCHEMBL8031578 0.74 TERT (0.49) L3MBTL1CYP2D6CYP19A1CYP2C9CYP2C19
SCHEMBL12190732 0.74 TERT (0.49) L3MBTL1CYP2D6CYP19A1CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070015742-A1 Porphyrin derivatives YAHIOGLU GOKHAN 2007-01-18 — — 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-20070015742-A1 Porphyrin derivatives SCO2, CBR3, CBR1 L3MBTL1 3006/4885TDP1 4330/4885CYP2D6 2544/4885

“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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