SCHEMBL1300560

SCHEMBL1300560

CC(C)C(CO)n1cc(C(=O)O)c(=O)c2cc(NCc3c(F)cc(F)cc3F)c(N(C)C)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 1/20 0.44
▸ TOP1 P11387 3/20 0.33
▸ HPGD P15428 4/20 0.33
▸ LMNA P02545 4/20 0.33
▸ POLB P06746 1/20 0.33
▸ TAAR1 Q96RJ0 1/20 0.33
▸ PIM1 P11309 1/20 0.32
▸ HSD17B10 Q99714 3/20 0.31
▸ ALDH1A1 P00352 4/20 0.31
▸ DRD3 P35462 1/20 0.31
▸ KDM4E B2RXH2 7/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ MEN1 O00255 2/20 0.30
▸ KMT2A Q03164 2/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ HTT P42858 3/20 0.30
▸ TSHR P16473 2/20 0.30
▸ BRD4 O60885 1/20 0.30
▸ CYP2J2 P51589 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
SCHEMBL1300556 1.00 METTL3 (0.44) METTL3TOP1HPGDLMNAPOLB
SCHEMBL1301640 0.87 METTL3 (0.55) METTL3TOP1HPGDLMNAPOLB
SCHEMBL1301634 0.87 METTL3 (0.55) METTL3TOP1HPGDLMNAPOLB
SCHEMBL12504058 0.85 METTL3 (0.48) METTL3TOP1HPGDLMNAPOLB
SCHEMBL1301280 0.83 METTL3 (0.46) METTL3TOP1HPGDLMNAPOLB
SCHEMBL1301282 0.83 METTL3 (0.46) METTL3TOP1HPGDLMNAPOLB
SCHEMBL16330167 0.81 METTL3 (0.38) METTL3HPGDLMNAPOLBPIM1
SCHEMBL1300293 0.79 METTL3 (0.61) METTL3TOP1HPGDLMNAPOLB
SCHEMBL1300296 0.79 METTL3 (0.61) METTL3TOP1HPGDLMNAPOLB
SCHEMBL12110907 0.79 TOP1 (0.38) METTL3TOP1HPGDLMNAPOLB

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-20110269741-A1 NOVEL COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. (US) 2011-11-03 — — US disclosed
US-20110166123-A1 NOVEL COMPOSITIONS AND METHODS OF USE AARDEA BIOSCIENCES, INC. (US) 2011-07-07 — — 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 (2 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-20110166123-A1 NOVEL COMPOSITIONS AND METHODS OF USE TYMP, SAMHD1, PNP METTL3 2709/4885TOP1 77/4885HPGD 1541/4885
US-20110269741-A1 NOVEL COMPOSITIONS AND METHODS OF USE TYMP, SAMHD1, PNP METTL3 2709/4885TOP1 77/4885HPGD 1541/4885

“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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