SCHEMBL10759991

SCHEMBL10759991

N#CC1Cc2ccccc2N1c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 4/20 0.39
▸ HPGD P15428 1/20 0.35
▸ MTNR1A P48039 3/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ SLC6A2 P23975 1/20 0.34
▸ DPP8 Q6V1X1 1/20 0.34
▸ AR P10275 2/20 0.34
▸ MTNR1B P49286 2/20 0.33
▸ GRM4 Q14833 1/20 0.33

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
SCHEMBL16525868 0.79 NOTUM (0.33) NOTUMMEN1NPC1POLBMAPT
SCHEMBL16264090 0.76 AR (0.35) NOTUMKMT2ADPP8AR
SCHEMBL10754980 0.76 AADAT (0.38) NOTUMMEN1NPC1POLBMAPT
SCHEMBL19954697 0.73 NOTUM (0.42) NOTUMHPGDMTNR1ASLC6A2MTNR1B
SCHEMBL22005465 0.73 ROCK1 (0.51) NOTUMHPGDNPC1POLBMAPT
SCHEMBL7075121 0.73 ROCK1 (0.51) NOTUMHPGDNPC1POLBMAPT
SCHEMBL11445560 0.73 NOTUM (0.42) NOTUMHPGDMTNR1ASLC6A2
SCHEMBL22923714 0.73 NOTUM (0.42) NOTUMHPGDMTNR1ASLC6A2MTNR1B
SCHEMBL18707381 0.73 NOTUM (0.42) NOTUMHPGDMTNR1ASLC6A2MTNR1B
SCHEMBL17652443 0.72 MTNR1A (0.40) MTNR1APOLBMTNR1B

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-4659731-A 2-(4,5-Dihydro-1H-imidazol-2-yl)-2,3-dihydroindole derivatives and their application as α2 receptor antagonist or α1 receptor agonists SYNTHELABO (FR) 1987-04-21 — — US disclosed
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