SCHEMBL8022137

SCHEMBL8022137

Nc1ccccc1SCc1ccccc1Br

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.57
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
MAPT P10636 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
APOBEC3G Q9HC16 1/20 0.46
TAAR1 Q96RJ0 1/20 0.45
IDO1 P14902 2/20 0.44
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
HIF1A Q16665 1/20 0.43
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
CDC7 O00311 1/20 0.41
DBF4 Q9UBU7 1/20 0.41
NPC1 O15118 1/20 0.41

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
SCHEMBL16242574 0.85 POLB (0.68) POLBMEN1KMT2AMAPTNPSR1
SCHEMBL16242814 0.83 POLB (0.65) POLBMEN1KMT2AMAPTNPSR1
SCHEMBL16351512 0.77 CYP1A2 (0.45) POLBMEN1KMT2AMAPTNPSR1
SCHEMBL16242607 0.76 POLB (0.57) POLBMEN1KMT2AMAPTNPSR1
SCHEMBL28346293 0.75 ALDH1A1 (0.46) MEN1KMT2ATAAR1IDO1CDC7
SCHEMBL19675345 0.74 POLB (0.71) POLBMEN1KMT2AMAPTNPSR1
Naphthalene SCHEMBL28721345 0.74 MGAM (0.45) MAPTTAAR1CYP1A2CYP2D6CYP2C19
SCHEMBL16242598 0.74 POLB (0.87) POLBMEN1KMT2AMAPTNPSR1
SCHEMBL10665398 0.74 TAAR1 (0.52) MEN1KMT2ATAAR1IDO1CYP1A2
SCHEMBL5855074 0.73 TAAR1 (0.50) TAAR1IDO1CYP1A2CYP2C19CDC7

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
US-6063779-A CARDIOVASCULAR DISORDERS MEIJI SEIKA KAISHA, LTD. (JP) 2000-05-16 US disclosed
EP-0878475-A2 5-(4-Piperidinyl)dibenzothiazepine derivatives and 5-(4-piperidinyl)dibenzoxazepine derivatives, and antiarrhythmic agents Meiji Seika Kaisha, Ltd. (JP) 1998-11-18 EP disclosed
EP-0404359-B1 Dibenzothiazepine derivatives useful as antispasmodic agents PFIZER LTD (GB) 1994-06-29 EP disclosed
US-5071844-A Antispasmodic agents PFIZER INC. (US) 1991-12-10 US disclosed
EP-0404359-A1 Dibenzothiazepine derivatives useful as antispasmodic agents Pfizer Limited (GB) 1990-12-27 EP disclosed