SCHEMBL5837254

SCHEMBL5837254

CC(=O)Cc1ccc2c(c1)n(C)c(=O)n2C

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 6/20 0.53
▸ HSD17B10 Q99714 3/20 0.53
▸ TP53 P04637 2/20 0.53
▸ ALDH1A1 P00352 6/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ BRD4 O60885 2/20 0.51
▸ BRPF1 P55201 2/20 0.51
▸ RAB9A P51151 1/20 0.49
▸ POLB P06746 2/20 0.49
▸ TSHR P16473 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ HTT P42858 2/20 0.48
▸ LMNA P02545 1/20 0.48
▸ GLA P06280 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ GAA P10253 1/20 0.44
▸ THRB P10828 1/20 0.43

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
SCHEMBL22862697 0.86 ALDH1A1 (0.65) SMN1; SMN2HSD17B10TP53ALDH1A1KDM4E
SCHEMBL22862695 0.82 TSHR (0.59) SMN1; SMN2HSD17B10TP53ALDH1A1KDM4E
SCHEMBL29490211 0.82 TSHR (0.59) SMN1; SMN2HSD17B10TP53ALDH1A1KDM4E
SCHEMBL22862586 0.81 SMN1; SMN2 (0.50) SMN1; SMN2HSD17B10TP53ALDH1A1KDM4E
SCHEMBL7479892 0.80 POLB (0.53) SMN1; SMN2HSD17B10TP53ALDH1A1KDM4E
SCHEMBL29490252 0.78 POLB (0.54) SMN1; SMN2HSD17B10TP53ALDH1A1KDM4E
SCHEMBL22862558 0.78 POLB (0.54) SMN1; SMN2HSD17B10TP53ALDH1A1KDM4E
SCHEMBL9388512 0.77 POLB (0.53) SMN1; SMN2HSD17B10TP53ALDH1A1KDM4E
SCHEMBL22862551 0.77 POLB (0.53) SMN1; SMN2HSD17B10TP53ALDH1A1KDM4E
SCHEMBL13156353 0.77 POLB (0.53) SMN1; SMN2HSD17B10TP53ALDH1A1KDM4E

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-7056918-B2 Benzimidazole anti-inflammatory compounds PFIZER, INC. (US) 2006-06-06 — — US disclosed
EP-1370557-B1 BENZIMIDAZOLE ANTI-INFLAMMATORY COMPOUNDS PFIZER PROD INC (US) 2005-11-16 — — EP disclosed
US-20030092749-A1 Novel benzimidazole anti-inflammatory compounds PFIZER INC. 2003-05-15 — — 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-20030092749-A1 Novel benzimidazole anti-inflammatory compounds MAPK1, JAK1, CNKSR1 SMN1; SMN2 1612/4885HSD17B10 2903/4885TP53 1764/4885

“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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