SCHEMBL5610837

SCHEMBL5610837

OCCCCn1cnc2ccccc21

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.70
▸ SMN1; SMN2 Q16637 8/20 0.65
▸ LMNA P02545 5/20 0.65
▸ TSHR P16473 2/20 0.65
▸ ALOX15 P16050 1/20 0.65
▸ EGLN3 Q9H6Z9 1/20 0.59
▸ HTT P42858 6/20 0.58
▸ MAPT P10636 4/20 0.58
▸ STAT3 P40763 1/20 0.58
▸ MEN1 O00255 2/20 0.57
▸ KMT2A Q03164 2/20 0.57
▸ NPC1 O15118 1/20 0.56
▸ NFKB1 P19838 1/20 0.56
▸ RAB9A P51151 1/20 0.56
▸ NFKB2 Q00653 1/20 0.56
▸ RELA Q04206 1/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ DRD2 P14416 2/20 0.54
▸ DRD4 P21917 2/20 0.54
▸ DRD3 P35462 2/20 0.54

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
SCHEMBL30058168 1.00 TDP1 (0.70) TDP1SMN1; SMN2LMNATSHRALOX15
SCHEMBL14740042 0.98 TDP1 (0.68) TDP1SMN1; SMN2LMNATSHRALOX15
SCHEMBL5888624 0.98 TDP1 (0.68) TDP1SMN1; SMN2LMNATSHRALOX15
SCHEMBL5610799 0.98 TDP1 (0.68) TDP1SMN1; SMN2LMNATSHRALOX15
SCHEMBL825505 0.95 TDP1 (0.72) TDP1SMN1; SMN2LMNATSHRALOX15
SCHEMBL3161153 0.91 TDP1 (0.84) TDP1SMN1; SMN2LMNATSHRALOX15
SCHEMBL9814241 0.89 TDP1 (0.81) TDP1SMN1; SMN2LMNATSHRALOX15
SCHEMBL352046 0.89 TDP1 (0.81) TDP1SMN1; SMN2LMNATSHRALOX15
Ammonia Solution, Strong SCHEMBL7100443 0.89 TDP1 (0.81) TDP1SMN1; SMN2LMNATSHRALOX15
SCHEMBL353009 0.89 TDP1 (0.81) TDP1SMN1; SMN2LMNATSHRALOX15

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8445533-B2 Andrographolide derivatives to treat viral infections CORNELL RESEARCH FOUNDATION, INC. (US) 2013-05-21 — — US disclosed
CN-102977321-A compound for solar cell electrolyte, preparation method thereof, electrolyte containing compound and solar cell EVERLIGHT CHEM IND CORP 2013-03-20 — — CN disclosed
US-20130056075-A1 COMPOUNDS FOR USE IN ELECTROLYTE FOR SOLAR CELL, METHOD FOR PREPARING THE SAME, AND ELECTROLYTE AND SOLAR CELL HAVING THE SAME EVERLIGHT USA, INC. (US) 2013-03-07 — — US disclosed
US-20130056075-A1 COMPOUNDS FOR USE IN ELECTROLYTE FOR SOLAR CELL, METHOD FOR PREPARING THE SAME, AND ELECTROLYTE AND SOLAR CELL HAVING THE SAME EVERLIGHT USA, INC. (US) 2013-03-07 — — US disclosed
US-20130056075-A1 COMPOUNDS FOR USE IN ELECTROLYTE FOR SOLAR CELL, METHOD FOR PREPARING THE SAME, AND ELECTROLYTE AND SOLAR CELL HAVING THE SAME EVERLIGHT USA, INC. (US) 2013-03-07 — — US disclosed
EP-1817024-A2 ANDROGRAPHOLIDE DERIVATIVES TO TREAT VIRAL INFECTIONS CORNELL RESEARCH FOUNDATION, INC. (US) 2007-08-15 — — EP disclosed
US-20060223785-A1 Andrographolide derivatives to treat viral infections CORNELL RESEARCH FOUNDATION, INC. 2006-10-05 — — US disclosed
WO-2006101538-A2 ANDROGRAPHOLIDE DERIVATIVES TO TREAT VIRAL INFECTIONS CORNELL RESEARCH FOUNDATION, INC. (US) 2006-09-28 — — WO disclosed
US-20020128208-A1 Nonpeptide agonists and antagonists of vasopressin receptors EMORY UNIVERSITY 2002-09-12 — — US disclosed
WO-2002047679-A2 NONPEPTIDE AGONISTS AND ANTAGONISTS OF VASOPRESSIN RECEPTORS EMORY UNIVERSITY (US) 2002-06-20 — — WO disclosed
US-4377578-A ANTIANAPHYLACTIC AGENTS, ANTIHISTAMINES JANSSEN PHARMACEUTICA, N.V. (BE) 1983-03-22 — — US disclosed
US-4250176-A BENZIMIDAZOLE-2-ONE, BENZOTHIAZOL-2-ONE, OR BENZOXAZOL-2-ONE SUBSTITUTIONS, ANTIANAPHALACTIC AGENTS, ANTIHISTAMINES JANSSEN PHARMACEUTICA N.V. (BE) 1981-02-10 — — US disclosed
US-4200641-A ANTIANAPHYLACTIC AGENTS, ANTIHISTAMINES JANSSEN PHARMACEUTICA, N.V. (BE) 1980-04-29 — — US disclosed
US-4175129-A Antiemetic 1-(benzoxazolylalkyl)-piperidine derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1979-11-20 — — US disclosed
US-4160836-A Antiemetic 1-(benzothiazolylalkyl)piperidine derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1979-07-10 — — US disclosed
US-4126687-A ANTIEMETIC, 1-(BENZIMIDAZOLYL-ALKYL)-PIPERIDINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1978-11-21 — — US disclosed
US-4126688-A ANTIEMETIC 1-(BENZOTRIAZOLYL-ALKYL)-PIPERIDINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1978-11-21 — — US disclosed
US-4110333-A ANTIEMETIC INTERMEDIATES JANSSEN PHARMACEUTICA N.V. (BE) 1978-08-29 — — US disclosed
US-4066772-A ANTIEMETICS JANSSEN PHARMACEUTICA N.V. (BE) 1978-01-03 — — US disclosed
US-4035369-A 1-Benzazolylalkyl-4-substituted-piperidines JANSSEN PHARMACEUTICA N.V. (BE) 1977-07-12 — — 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 (3 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-20130056075-A1 COMPOUNDS FOR USE IN ELECTROLYTE FOR SOLAR CELL, METHOD FOR PREPARING THE SAME, AND ELECTROLYTE AND SOLAR CELL HAVING THE SAME HCN2, SCNN1A, HCN1 TDP1 4412/4885SMN1; SMN2 3648/4885LMNA 494/4885
US-20060223785-A1 Andrographolide derivatives to treat viral infections HAVCR2, MAVS, EIF2AK2 TDP1 2239/4885SMN1; SMN2 3651/4885LMNA 2482/4885
US-20020128208-A1 Nonpeptide agonists and antagonists of vasopressin receptors AVPR1A, AVPR2, AVPR1B TDP1 3328/4885SMN1; SMN2 4469/4885LMNA 3740/4885

“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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