SCHEMBL11784247

SCHEMBL11784247

Cc1cccc2c1N(Cc1ccccc1)C(C)(C)CC2C

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AMPD2 Q01433 7/20 0.50
LMNA P02545 2/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
DRD2 P14416 1/20 0.38
DRD4 P21917 1/20 0.38
C5AR1 P21730 1/20 0.37
ELANE P08246 1/20 0.36
HSD11B1 P28845 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ACHE P22303 1/20 0.36
SIGMAR1 Q99720 1/20 0.35

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
SCHEMBL9636484 0.88 AMPD2 (0.44) AMPD2LMNAMAPTMEN1KMT2A
SCHEMBL11417270 0.82 MAPT (0.41) AMPD2LMNAMAPTMEN1KMT2A
SCHEMBL9073520 0.81 AMPD2 (0.49) AMPD2LMNADRD2DRD4
SCHEMBL9636472 0.80 AMPD2 (0.42) AMPD2LMNAMAPTMEN1KMT2A
SCHEMBL9637840 0.79 MAPT (0.41) AMPD2LMNAMAPTMEN1KMT2A
SCHEMBL9847602 0.78 DRD2 (0.49) AMPD2LMNAMAPTMEN1KMT2A
SCHEMBL11423221 0.78 MAPT (0.40) LMNAMAPTMEN1KMT2ANPSR1
SCHEMBL11783355 0.76 DRD2 (0.46) AMPD2LMNADRD2DRD4NPSR1
SCHEMBL11783262 0.75 AMPD2 (0.50) AMPD2LMNAMEN1KMT2ADRD2
SCHEMBL21452893 0.75 GAA (0.45) AMPD2LMNAMEN1KMT2AELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3991042-A Basic azo dyestuffs containing a benzthiazole and a tetrahydroquinoline nucleus BAYER AKTIENGESELLSCHAFT (DT) 1976-11-09 US disclosed