SCHEMBL11325609

SCHEMBL11325609

CNC(=S)NCCNCc1ncoc1CNCCNC(=S)NC

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 2/20 0.35
HRH4 Q9H3N8 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
QPCT Q16769 1/20 0.34
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
PHGDH O43175 1/20 0.31
MTNR1B P49286 1/20 0.30

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
SCHEMBL11312891 0.86 HTT (0.42) LMNA
SCHEMBL11310603 0.79 QPCT (0.39) HRH2HRH4HRH3QPCTKDM4E
SCHEMBL11325487 0.76 HRH2 (0.37) HRH2HRH4HRH3QPCTKDM4E
SCHEMBL11326134 0.74 QPCT (0.35) HRH2HRH4HRH3QPCTKDM4E
SCHEMBL11326312 0.74 QPCT (0.35) HRH2HRH4HRH3QPCTKDM4E
SCHEMBL11365036 0.73 LMNA (0.41) HRH2HRH4QPCTKDM4ELMNA
SCHEMBL11310375 0.73 HRH2 (0.35) HRH2HRH4HRH3QPCTKDM4E
SCHEMBL11329985 0.72 MAPKAPK2 (0.48) HRH2HRH4HRH3QPCTKDM4E
SCHEMBL11327070 0.72 QPCT (0.35) HRH2HRH4HRH3QPCTKDM4E
SCHEMBL11310164 0.72 MAPT (0.35) HRH2HRH4HRH3QPCTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4307101-A ANTIHISTAMINES AND ANTISECRETORY AGENTS OF THE THIOUREA OR UREA DERIVATIVES 5,6,7,8-TETRAHYDROIMIDAZO(1,5A)PYRIDINE SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1981-12-22 US disclosed
US-4293697-A ANTIHISTAMINES SMITH, KLINE & FRENCH LABORATORIES LIMITED (GB) 1981-10-06 US disclosed
US-4230865-A ANTIHISTAMINES SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1980-10-28 US disclosed
US-4226874-A ANTIHISTAMINES, ANTISECRETORY AGENTS, GASTRIC JUICE SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1980-10-07 US disclosed
US-4151288-A ANTHISTAMINES SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1979-04-24 US disclosed
US-4137234-A ANTIHISTAMINES SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1979-01-30 US disclosed
US-4018931-A INHIBITION OF H-2 HISTAMINE RECEPTORS SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) 1977-04-19 US disclosed
US-3950353-A HISTAMINE INHIBITORS SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) 1976-04-13 US disclosed