SCHEMBL4765142

SCHEMBL4765142

Cc1ccc2nc(C)cc(Nc3ccccc3CCc3ccccc3N)c2c1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.46
TP53 P04637 2/20 0.46
HTT P42858 2/20 0.46
LMNA P02545 2/20 0.46
PTPN11 Q06124 1/20 0.46
OPRL1 P41146 2/20 0.45
MITF O75030 2/20 0.45
MAPT P10636 2/20 0.45
KMT2A Q03164 2/20 0.45
JAK2 O60674 1/20 0.45
PAX8 Q06710 1/20 0.45
NCF1 P14598 1/20 0.43
SLC6A4 P31645 1/20 0.43
KDM4E B2RXH2 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
GFER P55789 1/20 0.43
GAA P10253 2/20 0.42

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
SCHEMBL14588005 0.93 L3MBTL1 (0.61) L3MBTL1SMN1; SMN2TP53HTTLMNA
SCHEMBL14588039 0.88 EHMT2 (0.49) L3MBTL1SMN1; SMN2TP53HTTLMNA
SCHEMBL14588025 0.86 L3MBTL1 (0.53) L3MBTL1SMN1; SMN2TP53HTTLMNA
SCHEMBL14588029 0.85 L3MBTL1 (0.52) L3MBTL1SMN1; SMN2TP53HTTLMNA
SCHEMBL14588037 0.83 TP53 (0.54) SMN1; SMN2TP53PTPN11OPRL1MAPT
SCHEMBL14588082 0.81 L3MBTL1 (0.48) L3MBTL1SMN1; SMN2TP53HTTLMNA
SCHEMBL14588028 0.80 SMN1; SMN2 (0.56) L3MBTL1SMN1; SMN2TP53HTTLMNA
SCHEMBL14588014 0.80 EHMT2 (0.55) L3MBTL1SMN1; SMN2TP53HTTLMNA
SCHEMBL14588020 0.80 TP53 (0.49) L3MBTL1SMN1; SMN2TP53LMNAPTPN11
SCHEMBL14588035 0.79 L3MBTL1 (0.46) L3MBTL1SMN1; SMN2TP53HTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1613322-A4 AMINOQUINOLINE COMPOUNDS TAIGEN BIOTECHNOLOGY CO LTD (TW) 2008-08-13 EP disclosed
US-7183413-B2 Aminoquinoline compounds TAIGEN BIOTECHNOLOGY (TW) 2007-02-27 US disclosed
EP-1613322-A2 AMINOQUINOLINE COMPOUNDS Taigen Biotechnology (TW) 2006-01-11 EP disclosed
WO-2004091485-A2 AMINOQUINOLINE COMPOUNDS TAIGEN BIOTECHNOLOGY (TW) 2004-10-28 WO disclosed
US-20040209902-A1 e.g., 1,4-bis[2,6-dimethylquinolin-4ylamino]butane; used to treat inflammatory and immune diseases by binding to CXCR3 receptors. TAIGEN BIOTECHNOLOGY (TW) 2004-10-21 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-20040209902-A1 e.g., 1,4-bis[2,6-dimethylquinolin-4ylamino]butane; used to treat inflammatory and immune diseases by binding to CXCR3 receptors. CXCR3, CXCL10, CXCR1 L3MBTL1 1815/4885SMN1; SMN2 4781/4885TP53 2907/4885

“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.