SCHEMBL15934278

SCHEMBL15934278

COc1ccc(NC2CCCCC2)cc1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
PTPN7 P35236 2/20 0.49
DUSP3 P51452 2/20 0.49
HPGD P15428 2/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
PDGFRB P09619 2/20 0.48
PDGFRA P16234 2/20 0.48
NPSR1 Q6W5P4 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43
TUBA4A P68366 1/20 0.43
TUBB4B P68371 1/20 0.43
TUBB3 Q13509 1/20 0.43
TUBB2A Q13885 1/20 0.43
TUBB8 Q3ZCM7 1/20 0.43
TUBA3E Q6PEY2 1/20 0.43

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
SCHEMBL15934219 0.98 PTPN7 (0.48) ALDH1A1PTPN7DUSP3HPGDLMNA
SCHEMBL15934309 0.85 FYN (0.44) ALDH1A1LMNATUBB4ATUBBTUBA3C
SCHEMBL27925396 0.85 TUBB4A (0.42) ALDH1A1LMNATUBB4ATUBBTUBA3C
SCHEMBL17048144 0.81 KMT2A (0.57) ALDH1A1HPGDPDGFRBPDGFRASMN1; SMN2
SCHEMBL6568628 0.80 NPC1 (0.65) ALDH1A1SMN1; SMN2NPC1RAB9AMEN1
SCHEMBL17048156 0.79 KMT2A (0.55) ALDH1A1HPGDLMNAMAPTPDGFRB
SCHEMBL4193485 0.79 POLB (0.60) POLBMEN1KMT2A
SCHEMBL6925007 0.79 RAB9A (0.48) ALDH1A1LMNAMAPTL3MBTL1SMN1; SMN2
SCHEMBL1397633 0.78 IDO1 (0.50) ALDH1A1LMNAMAPTPOLBMEN1
SCHEMBL7400686 0.78 APOBEC3G (0.54) ALDH1A1HPGDLMNAMAPTPDGFRB

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
WO-2014118093-A2 DYE COMPOSITION COMPRISING AT LEAST ONE PARTICULAR LIPOPHILIC META-AMINOPHENOL COUPLER IN A MEDIUM RICH IN FATTY SUBSTANCES, PROCESSES AND DEVICES L'OREAL (FR) 2014-08-07 WO disclosed