SCHEMBL8558228

SCHEMBL8558228

Cc1c(CCO)c2cccc3c2n1CCS3

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 11/20 0.52
BCL2 P10415 8/20 0.47
BCL2L1 Q07817 4/20 0.45
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
LIPG Q9Y5X9 1/20 0.42
MAPT P10636 2/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
NOTUM Q6P988 1/20 0.35
TNKS2 Q9H2K2 1/20 0.34

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
SCHEMBL8556189 0.86 MCL1 (0.49) MCL1BCL2BCL2L1HTR2AHTR2C
SCHEMBL17686343 0.79 MCL1 (0.54) MCL1BCL2BCL2L1LIPGMAPT
SCHEMBL17686345 0.75 MCL1 (0.56) MCL1BCL2BCL2L1LIPGMAPT
SCHEMBL8559870 0.74 HTR2A (0.76) MCL1BCL2BCL2L1HTR2AHTR2C
SCHEMBL17686337 0.69 MCL1 (0.70) MCL1BCL2BCL2L1
SCHEMBL17686302 0.66 MCL1 (0.53) MCL1BCL2BCL2L1MAPTLMNA
SCHEMBL17686308 0.65 MCL1 (1.00) MCL1BCL2BCL2L1
SCHEMBL8700039 0.64 KDM4E (0.67) MCL1BCL2BCL2L1LMNA
SCHEMBL11485653 0.63 MCL1 (0.50) MCL1BCL2BCL2L1HTR2AMAPT
SCHEMBL8137309 0.63 MCL1 (0.50) MCL1BCL2BCL2L1LIPGMAPT

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-0529452-B1 1,7-Condensed 3-(piperazinoalkyl)indol derivatives, process and intermediates for their preparation and pharmaceutical compositions containing them SOLVAY PHARM GMBH (DE) 1998-11-11 EP disclosed
US-5324725-A Antiinflammatory agent, antiallergen KALI-CHEMIE PHARMA GMBH (DE) 1994-06-28 US disclosed
EP-0529452-A2 1,7-Condensed 2-(piperazinoalkyl)indol derivatives, process and intermediates for their preparation and pharmaceutical compositions containing them Kali-Chemie Pharma GmbH (DE) 1993-03-03 EP disclosed