SCHEMBL11501075

SCHEMBL11501075

CCCCCc1csc2nc3ccccc3n12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.47
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.47
HTT P42858 1/20 0.47
EGFR P00533 2/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
TLR8 Q9NR97 3/20 0.43
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
CXCR4 P61073 1/20 0.41
AGTR1 P30556 1/20 0.40
AGTR2 P50052 1/20 0.40
ALDH1A1 P00352 2/20 0.40
CYP1A2 P05177 1/20 0.40
GLA P06280 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL8936671 0.75 EGFR (0.50) SMN1; SMN2LMNATSHRHTTEGFR
SCHEMBL2776006 0.72 KDM4E (0.62) SMN1; SMN2LMNATSHRHTTEGFR
SCHEMBL2170624 0.72 TLR7 (0.51) TLR7SMN1; SMN2HTTMEN1KMT2A
SCHEMBL9523615 0.69 EGFR (0.48) SMN1; SMN2LMNATSHRHTTEGFR
SCHEMBL13436033 0.69 SMN1; SMN2 (0.51) SMN1; SMN2LMNATSHRHTTEGFR
SCHEMBL18701121 0.69 SMN1; SMN2 (0.46) SMN1; SMN2LMNATSHRHTTEGFR
SCHEMBL18701233 0.68 HSD17B10 (0.45) SMN1; SMN2LMNATSHRHTTEGFR
SCHEMBL18083271 0.67 KDM4E (0.64) SMN1; SMN2TSHREGFRMEN1KMT2A
SCHEMBL17933567 0.67 MAPT (0.72) TLR7SMN1; SMN2LMNATSHRTLR8
SCHEMBL14760445 0.67 KDM4E (0.72) TLR7SMN1; SMN2LMNATSHRMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3070092-B1 3-PHENYL-THIAZOLO[3,2-A]BENZIMIDAZOLE DERIVATIVES AS ALDEHYDE DEHYDROGENASE 1 (ALDH-1) MODULATORS FOR THE TREATMENT OF BREAST CANCER OR LEUKEMIA, AND FOR MANIPULATING CULTURED ALDH-1 POSITIVE BREAST CANCER OR LEUKEMIA CELLS UNIV KING SAUD (SA) 2018-11-07 EP disclosed
US-4214089-A Thiazolo[3,2-a]benzimidazoles, imidazo [2,1-b]thiazoles, and related compounds as antineoplastic agents, and enhancers of the immune response AMERICAN HOME PRODUCTS CORPORATION (US) 1980-07-22 US disclosed
US-4214089-A Thiazolo[3,2-a]benzimidazoles, imidazo [2,1-b]thiazoles, and related compounds as antineoplastic agents, and enhancers of the immune response AMERICAN HOME PRODUCTS CORPORATION (US) 1980-07-22 US disclosed