Sugi Predict

Sugi Predict / Compounds / SCHEMBL7664779

SCHEMBL7664779

SCHEMBL7664779

CCN1C(=CC=CC=CC2=[N+](CC)c3ccc(S(=O)(=O)O)cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)O)ccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.57
▸ NPC1 O15118 1/20 0.57
▸ USP2 O75604 1/20 0.57
▸ S1PR2 O95136 1/20 0.57
▸ LMNA P02545 1/20 0.57
▸ POLB P06746 1/20 0.57
▸ MAPT P10636 1/20 0.57
▸ ALPG P10696 1/20 0.57
▸ THRB P10828 1/20 0.57
▸ PKM P14618 1/20 0.57
▸ XBP1 P17861 1/20 0.57
▸ CRHBP P24387 1/20 0.57
▸ HTT P42858 1/20 0.57
▸ RECQL P46063 1/20 0.57
▸ RAB9A P51151 1/20 0.57
▸ BLM P54132 1/20 0.57
▸ KMT2A Q03164 1/20 0.57
▸ CRHR2 Q13324 1/20 0.57
▸ SMN1; SMN2 Q16637 1/20 0.57
▸ NPSR1 Q6W5P4 1/20 0.57

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
SCHEMBL7664773 1.00 MEN1 (0.57) MEN1NPC1USP2S1PR2LMNA
SCHEMBL13256374 1.00 MEN1 (0.57) MEN1NPC1USP2S1PR2LMNA
SCHEMBL7662999 0.96 MEN1 (0.61) MEN1NPC1USP2S1PR2LMNA
SCHEMBL7663002 0.96 MEN1 (0.61) MEN1NPC1USP2S1PR2LMNA
SCHEMBL15724446 0.93 PTPN1 (0.49) MEN1NPC1USP2S1PR2LMNA
SCHEMBL15304505 0.92 FOLH1 (0.49) MEN1NPC1USP2S1PR2LMNA
SCHEMBL16076513 0.91 BLM (0.57) MEN1NPC1USP2S1PR2LMNA
SCHEMBL13911358 0.90 PTPN1 (0.53) MEN1NPC1USP2S1PR2LMNA
SCHEMBL15483813 0.90 MEN1 (0.44) MEN1NPC1USP2S1PR2LMNA
SCHEMBL19662368 0.90 FOLH1 (0.48) MEN1NPC1USP2S1PR2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1112254-B1 CYANINE DYES AND SYNTHESIS METHODS THEREOF NEN LIFE SCIENCE PROD INC (US) 2013-02-27 — — EP disclosed
US-6437141-B2 FOR LABELING TARGET MOLECULES NEN LIFE SCIENCE PRODUCTS, INC. 2002-08-20 — — US disclosed
US-20010020098-A1 For labeling target molecules NEN LIFE SCIENCE PRODUCTS, INC. 2001-09-06 — — US disclosed
US-6224644-B1 CYANINE DYES INCLUDES FREE OR PROTECTED THIOL, AMINE OR HYDROXY SUBSTITUENT CAPABLE OF REACTING WITH A TARGET MOLECULE THROUGH A NEUCLOPHILIC DISPLACEMENT, USEFUL IN LABELING A VARIETY OF TARGET MOLECULES NEN LIFE SCIENCE PRODUCTS, INC. 2001-05-01 — — US disclosed
US-6204389-B1 DEBLOCKING; NUCLEOPHILIC DISPLACEMENT NEN LIFE SCIENCE PRODUCTS, INC. 2001-03-20 — — US disclosed
US-6197956-B1 FLUORESCENT BENZIMIDAZOLE, BENZOTHIAZOLE, BENZOXAZOLE, BENZOTHIAZINE, BENZOXAZINE AND QUINOLINE DYES NEN LIFE SCIENCE PRODUCTS, INC. 2001-03-06 — — US disclosed
US-6114350-A Cyanine dyes and synthesis methods thereof NEN LIFE SCIENCE PRODUCTS, INC. (US) 2000-09-05 — — 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-20010020098-A1 For labeling target molecules CYC1, THEM6, TPH1 MEN1 1688/4885NPC1 2120/4885USP2 2547/4885

“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.