SCHEMBL11315518

SCHEMBL11315518

CNC(=S)NCCCNCc1ccon1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 2/20 0.37
HRH4 Q9H3N8 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
QPCT Q16769 1/20 0.36
ATM Q13315 1/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
KDM1A O60341 9/20 0.34
MAOB P27338 6/20 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
SCHEMBL11329927 0.92 LMNA (0.36) HRH2HRH4HRH3QPCTATM
SCHEMBL11323741 0.81 LMNA (0.36) HRH2HRH4HRH3QPCTATM
SCHEMBL11318810 0.79 ALDH1A1 (0.37) HRH2HRH4ATMLMNA
SCHEMBL11321906 0.79 KMT2A (0.39) HRH2HRH4QPCTATMLMNA
SCHEMBL11324868 0.78 LMNA (0.38) HRH2HRH4HRH3QPCTKDM4E
SCHEMBL11312797 0.76 POLB (0.41) KDM4ELMNA
SCHEMBL11749283 0.76 KMT2A (0.36) HRH2HRH4ATM
SCHEMBL11326415 0.75 HRH2 (0.40) HRH2HRH4HRH3QPCTKDM4E
SCHEMBL11327142 0.75 LMNA (0.38) HRH2HRH4HRH3KDM4ELMNA
SCHEMBL11102412 0.75 SMN1; SMN2 (0.38) KDM4ELMNA

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