SCHEMBL11097045

SCHEMBL11097045

O=C1C(c2ccc(Cl)cc2)SC2Sc3ccc(Cl)cc3N12

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HTR7 P34969 1/20 0.33
MEN1 O00255 2/20 0.32
HTT P42858 2/20 0.32
KMT2A Q03164 2/20 0.32
SRD5A1 P18405 1/20 0.32
GSK3B P49841 1/20 0.32
ALDH1A1 P00352 4/20 0.32
NPSR1 Q6W5P4 1/20 0.32
VHL P40337 1/20 0.31
ELOC Q15369 1/20 0.31
ELOB Q15370 1/20 0.31
AADAT Q8N5Z0 1/20 0.31
NOTUM Q6P988 1/20 0.31

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
SCHEMBL7320987 0.92 MEN1 (0.38) MAPTMEN1HTTKMT2AGSK3B
SCHEMBL10809610 0.65 ITGB2 (0.51) LMNAMAPTHTR7MEN1KMT2A
SCHEMBL11014231 0.64 OPRK1 (0.37) LMNAMEN1HTTKMT2A
SCHEMBL11272811 0.64 SRD5A1 (0.37) LMNAMAPTMEN1HTTKMT2A
SCHEMBL10509753 0.62 ALOX15 (0.50) LMNAMAPTMEN1HTTKMT2A
SCHEMBL10808729 0.61 GSK3B (0.41) LMNAMAPTMEN1KMT2ASRD5A1
SCHEMBL10672173 0.59 OPRK1 (0.37) LMNA
SCHEMBL7269675 0.59 CA2 (0.40) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL27034742 0.58 GRIA1 (0.38) LMNAMAPTHTR7MEN1KMT2A
SCHEMBL10507148 0.57 ALOX15 (0.53) LMNAMAPTMEN1HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0021773-B1 THIAZOLO (2,3-B) BENZO (AND AZABENZO) THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AMERICAN HOME PRODUCTS CORPORATION (US) 1984-08-01 EP claimed
US-4275065-A USEFUL FOR SKIN GRAFTS AND ORGAN TRANSPLANTS AMERICAN HOME PRODUCTS CORPORATION (US) 1981-06-23 US claimed
EP-0021773-B1 THIAZOLO (2,3-B) BENZO (AND AZABENZO) THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AMERICAN HOME PRODUCTS CORPORATION (US) 1984-08-01 EP disclosed
US-4275065-A USEFUL FOR SKIN GRAFTS AND ORGAN TRANSPLANTS AMERICAN HOME PRODUCTS CORPORATION (US) 1981-06-23 US disclosed
EP-0021773-A1 Thiazolo (2,3-b) benzo (and azabenzo) thiazole derivatives, process for their preparation and pharmaceutical compositions containing them AMERICAN HOME PRODUCTS CORPORATION (US) 1981-01-07 EP disclosed