SCHEMBL11323741

SCHEMBL11323741

CNC(=S)NCCCSCc1ccon1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.36
HTT P42858 1/20 0.36
RECQL P46063 1/20 0.36
HRH2 P25021 2/20 0.36
HRH4 Q9H3N8 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
QPCT Q16769 1/20 0.35
ATM Q13315 1/20 0.34
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MTNR1B P49286 2/20 0.31
ALDH1A1 P00352 2/20 0.30
MAPT P10636 2/20 0.30
HPGD P15428 1/20 0.30
ALOX12 P18054 1/20 0.30
MTNR1A P48039 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
SCHEMBL11102412 0.92 SMN1; SMN2 (0.38) LMNAHTTRECQLKDM4EGAA
SCHEMBL10862915 0.85 MAPT (0.36) LMNAHTTRECQLATMSMN1; SMN2
SCHEMBL11752164 0.84 ATM (0.33) LMNAHTTRECQLATM
SCHEMBL10999537 0.83 MAPT (0.38) LMNAHTTRECQLGAASMN1; SMN2
SCHEMBL11315518 0.81 HRH2 (0.37) LMNAHRH2HRH4HRH3QPCT
SCHEMBL11329050 0.80 MAPT (0.37) LMNAHTTRECQLHRH4ATM
SCHEMBL11315608 0.80 SMN1; SMN2 (0.37) LMNAHTTRECQLHRH2HRH4
SCHEMBL11085100 0.78 LMNA (0.38) LMNAHTTRECQLGAASMN1; SMN2
SCHEMBL11329927 0.78 LMNA (0.36) LMNAHTTHRH2HRH4HRH3
SCHEMBL11314513 0.77 HRH2 (0.39) LMNAHTTRECQLHRH2HRH4

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 7 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-3950353-A HISTAMINE INHIBITORS SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) 1976-04-13 US disclosed