SCHEMBL11323779

SCHEMBL11323779

CNC(=S)NCCSCc1nc(C)c(Br)s1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MAPT P10636 3/20 0.32
▸ LMNA P02545 2/20 0.32
▸ ALOX12 P18054 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ ACHE P22303 1/20 0.32

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
SCHEMBL11324632 0.86 SMN1; SMN2 (0.35) SMN1; SMN2MAPTLMNAALOX12ALDH1A1
SCHEMBL11369719 0.78 CYP3A4 (0.34) SMN1; SMN2MAPTLMNAACHE
SCHEMBL11324803 0.78 SMN1; SMN2 (0.33) SMN1; SMN2MAPTLMNAALOX12ALDH1A1
SCHEMBL11326434 0.75 ACHE (0.39) SMN1; SMN2MAPTLMNAALOX12ALDH1A1
SCHEMBL11317906 0.74 SMN1; SMN2 (0.34) SMN1; SMN2MAPTLMNAALOX12ALDH1A1
SCHEMBL11369717 0.73 CYP3A4 (0.53) SMN1; SMN2MAPTLMNAACHE
SCHEMBL11103663 0.73 GLS (0.41) SMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL11323776 0.73 — —
SCHEMBL10425817 0.72 SMN1; SMN2 (0.33) SMN1; SMN2MAPTLMNAALOX12ALDH1A1
SCHEMBL11314873 0.70 MAPT (0.35) SMN1; SMN2MAPTLMNAALOX12ALDH1A1

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
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