SCHEMBL998711

SCHEMBL998711

Cc1cc(C)cc(NC(=O)N2CC3(CC3)c3c([nH]c4ccccc34)C2c2ccc(F)cc2)c1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.48
MAPT P10636 4/20 0.45
ABCB1 P08183 1/20 0.43
ABCG2 Q9UNQ0 1/20 0.43
NPSR1 Q6W5P4 2/20 0.42
POLB P06746 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PAX8 Q06710 2/20 0.41
LMNA P02545 3/20 0.41

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
SCHEMBL998843 0.93 TP53 (0.44) TP53MAPTABCB1ABCG2NPSR1
SCHEMBL1000909 0.93 PAX8 (0.45) TP53MAPTNPSR1POLBPAX8
SCHEMBL997308 0.92 ABCG2 (0.47) TP53MAPTABCB1ABCG2NPSR1
SCHEMBL997552 0.90 PAX8 (0.44) TP53MAPTNPSR1POLBPAX8
SCHEMBL997842 0.90 TP53 (0.53) TP53MAPTABCB1ABCG2POLB
SCHEMBL997501 0.90 TP53 (0.46) TP53MAPTABCB1ABCG2NPSR1
SCHEMBL998373 0.90 PAX8 (0.44) TP53MAPTNPSR1POLBPAX8
SCHEMBL997421 0.89 NPC1 (0.45) TP53MAPTABCB1ABCG2NPSR1
SCHEMBL997511 0.89 TP53 (0.44) TP53MAPTNPSR1POLBPAX8
SCHEMBL2033807 0.88 TP53 (0.49) TP53MAPTABCB1ABCG2NPSR1

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-7872133-B2 Tricyclic heterocycle compound ONO PHARMACEUTICAL CO., LTD. (JP) 2011-01-18 US disclosed
US-20060154944-A1 Novel tricyclic heterocycle compound ONO PHARMACEUTICAL CO., LTD. (JP) 2006-07-13 US disclosed
EP-1637521-A1 NOVEL TRICYCLIC HETEROCYCLE COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2006-03-22 EP 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-20060154944-A1 Novel tricyclic heterocycle compound CYP11B1, CYP11B2, HCCS TP53 945/4885MAPT 4705/4885ABCB1 307/4885

“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.