SCHEMBL6201997

SCHEMBL6201997

NCCCCC(N)C(=O)OCCCc1cc(F)c2ncc(C(=O)NCc3ccc(Cl)cc3)c(O)c2c1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.37
LMNA P02545 2/20 0.35
NR3C1 P04150 1/20 0.35
PPARG P37231 1/20 0.35
GSK3B P49841 1/20 0.35
THRB P10828 1/20 0.34
POLA1 P09884 1/20 0.34
CNR2 P34972 2/20 0.34
HPGD P15428 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
CYP1A1 P04798 1/20 0.34
EPHX2 P34913 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
PTGER4 P35408 1/20 0.33
PTGER2 P43116 1/20 0.33
PDPK1 O15530 1/20 0.33

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
Trifluoroacetic Acid SCHEMBL6198172 0.96 LMNA (0.36) EGLN1LMNAPPARGCNR2CYP1A2
SCHEMBL6198178 0.88 EGLN1 (0.38) EGLN1LMNANR3C1PPARGGSK3B
SCHEMBL6198179 0.87 LMNA (0.35) EGLN1LMNANR3C1PPARGCNR2
SCHEMBL6200535 0.86 EGLN1 (0.42) EGLN1LMNANR3C1PPARGGSK3B
SCHEMBL6199123 0.85 EGLN1 (0.39) EGLN1LMNANR3C1PPARGGSK3B
SCHEMBL6200092 0.84 EGLN1 (0.38) EGLN1LMNANR3C1PPARGGSK3B
SCHEMBL6202008 0.83 EGLN1 (0.41) EGLN1LMNANR3C1PPARGGSK3B
SCHEMBL6198604 0.83 EGLN1 (0.41) EGLN1LMNANR3C1PPARGGSK3B
SCHEMBL6200398 0.83 EGLN1 (0.44) EGLN1LMNANR3C1PPARGGSK3B
SCHEMBL6202009 0.83 EGLN1 (0.40) EGLN1LMNANR3C1PPARGGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1042295-B1 4-HYDROXYQUINOLINE-3-CARBOXAMIDES AND HYDRAZIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN CO LLC (US) 2005-09-07 EP claimed
US-20040186131-A1 Method of preventing or treating atherosclerosis or restenosis WATHEN MICHAEL W 2004-09-23 US claimed
US-6093732-A PREVENT HERPESVIRAL INFECTIONS, PARTICULARLY, HUMAN CYTOMEGALOVIRAL INFECTION PHARMACIA & UPJOHN COMPANY (US) 2000-07-25 US claimed
EP-1042295-B1 4-HYDROXYQUINOLINE-3-CARBOXAMIDES AND HYDRAZIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN CO LLC (US) 2005-09-07 EP disclosed
US-20040186131-A1 Method of preventing or treating atherosclerosis or restenosis WATHEN MICHAEL W 2004-09-23 US disclosed
US-6093732-A PREVENT HERPESVIRAL INFECTIONS, PARTICULARLY, HUMAN CYTOMEGALOVIRAL INFECTION PHARMACIA & UPJOHN COMPANY (US) 2000-07-25 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-20040186131-A1 Method of preventing or treating atherosclerosis or restenosis LDLR, NR1H3, NR1H2 EGLN1 1974/4885LMNA 459/4885NR3C1 1216/4885

“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.