SCHEMBL11949034

SCHEMBL11949034

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

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 1/20 0.51
▸ KDM4E B2RXH2 3/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ HPGD P15428 3/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ TP53 P04637 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ CHEK2 O96017 3/20 0.49
▸ GAA P10253 1/20 0.48
▸ TCF4 P15884 1/20 0.46
▸ CTNNB1 P35222 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ BAZ1A Q9NRL2 1/20 0.45
▸ HPSE Q9Y251 1/20 0.45
▸ NPC1 O15118 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ RAB9A P51151 1/20 0.44

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
SCHEMBL11956753 0.90 ALDH1A1 (0.51) KDM4EALDH1A1HPGDMEN1TP53
SCHEMBL11949039 0.89 NR4A2 (0.55) NR4A2CHEK2
SCHEMBL11949031 0.88 NR4A2 (0.48) NR4A2CHEK2TCF4CTNNB1
SCHEMBL11949019 0.87 SLC2A1 (0.52) KDM4EALDH1A1HPGDMEN1TP53
SCHEMBL11949036 0.86 NR4A2 (0.47) NR4A2CHEK2
SCHEMBL11949037 0.86 MMP2 (0.55) NR4A2KMT2ACHEK2HPSEMAPT
SCHEMBL11949027 0.86 NR4A2 (0.46) NR4A2CHEK2TCF4CTNNB1HPSE
SCHEMBL11949009 0.86 MMP2 (0.52) NR4A2CHEK2HPSE
SCHEMBL15275494 0.85 NR2E3 (0.48) NR4A2KDM4ETP53KMT2ACHEK2
SCHEMBL11949042 0.85 HDAC6 (0.53) NR4A2CHEK2HPSE

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 NR4A2 4742/4885KDM4E 2675/4885ALDH1A1 405/4885

“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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