SCHEMBL11949045

SCHEMBL11949045

CCN(CC)c1cc2[nH]c(-c3ccc(F)cc3)nc2cc1NC(=O)c1ccccc1OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRPF1 P55201 1/20 0.55
▸ CHEK2 O96017 2/20 0.50
▸ MAPT P10636 4/20 0.48
▸ KDM4E B2RXH2 3/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ TP53 P04637 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ FOXO1 Q12778 1/20 0.47
▸ NPC1 O15118 3/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ HPGD P15428 2/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ AMY1A P0DUB6 2/20 0.46
▸ HSP90AA1 P07900 1/20 0.45
▸ PKM P14618 1/20 0.45
▸ PAX8 Q06710 1/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ LMNA P02545 1/20 0.45

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
SCHEMBL11949062 0.88 BRPF1 (0.58) BRPF1CHEK2MAPTKDM4ESMN1; SMN2
SCHEMBL11949044 0.86 AMY1A (0.49) CHEK2MAPTSMN1; SMN2POLBAMY1A
SCHEMBL11949037 0.86 MMP2 (0.55) CHEK2MAPTKMT2ANR2E3CYP2C9
SCHEMBL11949039 0.85 NR4A2 (0.55) CHEK2
SCHEMBL11949029 0.84 PRSS12 (0.56) CHEK2MAPTKDM4ESMN1; SMN2NPC1
SCHEMBL11949041 0.84 PRSS12 (0.56) CHEK2MAPTKDM4ESMN1; SMN2NPC1
SCHEMBL11949005 0.84 NR4A2 (0.52) CHEK2MAPTKDM4EPOLBNPC1
SCHEMBL11949009 0.83 MMP2 (0.52) CHEK2
SCHEMBL31748608 0.83 NR2E3 (0.63) CHEK2MAPTKDM4ENPC1RAB9A
SCHEMBL26597196 0.83 NR2E3 (0.63) CHEK2MAPTKDM4ENPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8232410-B2 Benzimidazoles and pharmaceutical compositions thereof THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2012-07-31 — — US disclosed
US-8232410-B2 Benzimidazoles and pharmaceutical compositions thereof THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2012-07-31 — — US disclosed
US-20100256203-A1 BENZIMIDAZOLES AND PHARMACEUTICAL COMPOSITIONS THEREOF THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK 2010-10-07 — — US disclosed
US-20100256203-A1 BENZIMIDAZOLES AND PHARMACEUTICAL COMPOSITIONS THEREOF THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK 2010-10-07 — — 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 (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-20100256203-A1 BENZIMIDAZOLES AND PHARMACEUTICAL COMPOSITIONS THEREOF TBCD, TBC1D5, CFTR BRPF1 266/4885CHEK2 3766/4885MAPT 3796/4885

“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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