SCHEMBL6809961

SCHEMBL6809961

CC(C)(C)[Si](NCc1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.42
MAPT P10636 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ADH1B P00325 1/20 0.39
ADH1C P00326 1/20 0.39
ADH1A P07327 1/20 0.39
ADH7 P40394 1/20 0.39
IDO1 P14902 2/20 0.39
THRB P10828 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
RIPK1 Q13546 1/20 0.39
LMNA P02545 2/20 0.38
CYP2D6 P10635 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
ALOX12 P18054 1/20 0.38
RAB9A P51151 1/20 0.37
SLC6A2 P23975 1/20 0.36

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
SCHEMBL19600559 0.76 KIF11 (0.40) CYP3A4CYP2D6SLC6A2TAAR1SMN1; SMN2
SCHEMBL841941 0.74 TAAR1 (0.34) LMNACYP2D6SLC6A2TAAR1
SCHEMBL11099246 0.74 CYP3A4 (0.46) CYP3A4MAPTKDM4EADH1BADH1C
SCHEMBL6282747 0.71 HDAC3 (0.36) CYP3A4MAPTKDM4EIDO1GAA
SCHEMBL3273386 0.70 IDO1 (0.54) CYP3A4MAPTKDM4EADH1BADH1C
Hydrochloric Acid SCHEMBL23928399 0.69 HDAC3 (0.35) CYP3A4IDO1GAATAAR1HTT
SCHEMBL3122253 0.69 IDO1 (0.52) CYP3A4MAPTKDM4EADH1BADH1C
SCHEMBL27946817 0.68 MEN1 (0.38) CYP3A4MAPTKDM4EIDO1THRB
SCHEMBL27946821 0.68 CYP3A4 (0.37) CYP3A4MAPTKDM4EIDO1THRB
SCHEMBL6907584 0.67 IDO1 (0.50) CYP3A4MAPTKDM4EADH1BADH1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040023818-A1 Method and product for enhancing the clean-up of hydrocarbon-producing well HALLIBURTON ENERGY SERVICES, INC. 2004-02-05 US claimed
US-20040023818-A1 Method and product for enhancing the clean-up of hydrocarbon-producing well HALLIBURTON ENERGY SERVICES, INC. 2004-02-05 US disclosed
EP-0400916-B1 4,5,6,11-Tetrahydrobenzo [6,7]-cycloocta[1,2-b]thiophen-6,11-imines and 6,11-dihydrobenzo[6,7]-cycloocta[1,2-b]thiophen-6,11 imines PFIZER (US) 1994-11-09 EP disclosed
US-5260309-A 4,5,6,11-tetrahydrobenzo [6,7] cycloocta [1,2-b]thiophen-6,11-imines and 6,11-dihydrobenzo [6,7] cycloocta [1,2-b] thiophen-6,11-imines PFIZER INC. (US) 1993-11-09 US disclosed
WO-1990015060-A1 4,5,6,11-TETRAHYDROBENZO[6,7]CYCLOOCTA[1,2-b]THIOPHEN-6,11-IMINES AND 6,11-DIHYDROBENZO[6,7]CYCLOOCTA[1,2-b]THIOPHEN-6,11-IMINES PFIZER INC. (US) 1990-12-13 WO disclosed
EP-0400916-A2 4,5,6,11-Tetrahydrobenzo [6,7]-cycloocta[1,2-b]thiophen-6,11-imines and 6,11-dihydrobenzo[6,7]-cycloocta[1,2-b]thiophen-6,11 imines PFIZER INC. (US) 1990-12-05 EP disclosed