SCHEMBL11311196

SCHEMBL11311196

O=C(NC(=S)NCCCNc1nncs1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.54
ALDH1A1 P00352 11/20 0.51
ALOX12 P18054 5/20 0.51
RAB9A P51151 3/20 0.48
MITF O75030 1/20 0.47
KDM4E B2RXH2 2/20 0.45
ACHE P22303 1/20 0.43
MIF P14174 1/20 0.43
NPC1 O15118 2/20 0.43
LMNA P02545 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
RECQL P46063 1/20 0.43
GAA P10253 1/20 0.42
MAPT P10636 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL11325023 0.81 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1ALOX12RAB9AMITF
SCHEMBL15328268 0.81 SMN1; SMN2 (0.77) SMN1; SMN2ALDH1A1ALOX12RAB9AMITF
SCHEMBL14096368 0.80 MIF (0.62) SMN1; SMN2ALDH1A1RAB9AKDM4EMIF
SCHEMBL11312033 0.78 SMN1; SMN2 (0.55) SMN1; SMN2ALDH1A1ALOX12RAB9AMITF
SCHEMBL15328351 0.77 SMN1; SMN2 (0.71) SMN1; SMN2ALDH1A1ALOX12RAB9AMITF
SCHEMBL11313298 0.77 RAB9A (0.63) SMN1; SMN2ALDH1A1ALOX12RAB9AMITF
SCHEMBL11312703 0.76 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1ALOX12RAB9AMITF
SCHEMBL11321928 0.76 TSHR (0.46) SMN1; SMN2KDM4EMIFLMNAKMT2A
SCHEMBL15328470 0.75 ALDH1A1 (0.78) SMN1; SMN2ALDH1A1ALOX12RAB9AMITF
SCHEMBL11703253 0.75 RAB9A (0.64) SMN1; SMN2ALDH1A1ALOX12RAB9AMITF

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