SCHEMBL2973124

SCHEMBL2973124

CN(C)CCCNc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C(=O)Nc3cc(F)cc(N4CCOCC4)c3)ccc2Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.48
KMT2A Q03164 5/20 0.48
ALDH1A1 P00352 7/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
LMNA P02545 3/20 0.47
HTT P42858 2/20 0.47
GAA P10253 1/20 0.47
MEN1 O00255 4/20 0.45
RAC1 P63000 1/20 0.43
NPC1 O15118 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
RAB9A P51151 1/20 0.41
POLB P06746 1/20 0.41
PLAU P00749 1/20 0.40
MAPK14 Q16539 1/20 0.40
CASP3 P42574 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL7822850 0.91 MAPT (0.48) MAPTKMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL2967441 0.90 MAPT (0.43) MAPTKMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL2965603 0.90 PLAU (0.44) MAPTKMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL2971883 0.88 MAPT (0.42) MAPTKMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL2979467 0.85 MAPT (0.50) MAPTKMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL7825920 0.84 MAPT (0.41) MAPTKMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL2980235 0.84 SIRT6 (0.51) MAPTKMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL27539907 0.83 MAPT (0.45) MAPTKMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL4831830 0.82 MAPT (0.40) MAPTKMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL7854478 0.82 MAPK14 (0.45) MAPTKMT2AALDH1A1SMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7772432-B2 Amidobenzamide derivatives which are useful as cytokine inhibitors ASTRAZENECA AB (SE) 2010-08-10 US disclosed
US-7442704-B2 Amide derivatives ASTRAZENECA AB (SE) 2008-10-28 US disclosed
US-7332483-B2 3-(5-benzamido-2-chlorophenyl)-7-methoxy-3,4-dihydroquinazolin-4-one;cytokines (tumor necrosis factor and interleukins) inhibitor; antiinflammatory agent, rheumatoid arthritis, osteoarthritis, psoriasis, chronic obstructive pulmonary disease ASTRAZENECA AB (SE) 2008-02-19 US disclosed
US-20060281734-A1 Amide derivatives BROWN DEARG S 2006-12-14 US disclosed
US-7008945-B1 Amide derivatives ASTRAZENECA AB (SE) 2006-03-07 US disclosed
CN-1243724-C Amide derivatives which are useful as cell factor inhibitors ASTRA ZENECA LTD (SE) 2006-03-01 CN disclosed
US-20050038081-A1 Amidobenzamide derivatives which are useful as cytokine inhibitors ASTRAZENECA 2005-02-17 US disclosed
US-6821965-B1 IMPORTANT IN DISEASE OR MEDICAL CONDITIONS SUCH AS INFLAMMATION AND IMMUNOREGULATION ASTERZENECA AB (SE) 2004-11-23 US disclosed
CN-1330631-A Amide derivatives which are useful as cell factor inhibitors ASTRA ZENECA LTD (SE) 2002-01-09 CN disclosed
EP-1163237-A1 AMIDE DERIVATIVES AstraZeneca AB (SE) 2001-12-19 EP disclosed
EP-1102743-A1 AMIDE DERIVATIVES WHICH ARE USEFUL AS CYTOKINE INHIBITORS AstraZeneca AB (SE) 2001-05-30 EP disclosed
WO-2000055153-A1 AMIDE DERIVATIVES ASTRAZENECA AB (SE) 2000-09-21 WO disclosed
WO-2000007980-A1 AMIDE DERIVATIVES WHICH ARE USEFUL AS CYTOKINE INHIBITORS ASTRAZENECA AB (SE) 2000-02-17 WO 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-20050038081-A1 Amidobenzamide derivatives which are useful as cytokine inhibitors IL6, IL6ST, IL2 MAPT 4659/4885KMT2A 1554/4885ALDH1A1 293/4885
US-20060281734-A1 Amide derivatives IL6, IL6ST, IL1B MAPT 4431/4885KMT2A 2740/4885ALDH1A1 269/4885

“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.