SCHEMBL11323700

SCHEMBL11323700

CN(C)CCNC(=S)NCCSCc1cc[nH]n1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.40
POLB P06746 2/20 0.40
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
KMT2A Q03164 4/20 0.38
MAPT P10636 3/20 0.37
ALOX12 P18054 2/20 0.37
ACHE P22303 2/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
MEN1 O00255 2/20 0.35
GAA P10253 1/20 0.35
HTT P42858 1/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL10858680 0.85 MAPT (0.38) LMNAKMT2AMAPTALOX12SMN1; SMN2
SCHEMBL11819562 0.84 MAPT (0.40) LMNAKMT2AMAPTALOX12SMN1; SMN2
SCHEMBL11328903 0.81 POLB (0.41) LMNAPOLBCA12CA1CA2
SCHEMBL11314420 0.79 LMNA (0.39) LMNAPOLBCA12CA1CA2
SCHEMBL11321273 0.79 LMNA (0.39) LMNAPOLBCA12CA1CA2
SCHEMBL11489212 0.78 ACHE (0.37) LMNAPOLBMAPTACHESMN1; SMN2
SCHEMBL11315121 0.78 IDO1 (0.34) LMNAKMT2AMAPTALOX12SMN1; SMN2
SCHEMBL11314905 0.78 KMT2A (0.39) LMNAPOLBCA12CA1CA2
SCHEMBL11314513 0.76 HRH2 (0.39) LMNAKMT2AMAPTALOX12SMN1; SMN2
SCHEMBL11319221 0.76 LMNA (0.36) LMNAPOLBCA12CA1CA2

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