SCHEMBL9767852

SCHEMBL9767852

COC(=O)C(C)(Cc1ccccc1Cl)C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.46
RAB9A P51151 2/20 0.46
LMNA P02545 2/20 0.44
CTSK P43235 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 2/20 0.42
KCNJ6 P48051 1/20 0.42
KCNJ5 P48544 1/20 0.42
KCNJ3 P48549 1/20 0.42
MAPT P10636 1/20 0.42
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
HTT P42858 1/20 0.41
KCNN4 O15554 1/20 0.41

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
SCHEMBL16796683 0.83 NPC1 (0.46) NPC1RAB9ALMNACTSKMEN1
SCHEMBL3606752 0.75 LMNA (0.44) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL3606756 0.75 LMNA (0.44) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL17101270 0.74 LMNA (0.46) LMNAMEN1KMT2AALDH1A1HTT
SCHEMBL10584191 0.74 ALDH1A1 (0.49) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL11566872 0.74 RAB9A (0.46) NPC1RAB9ACTSKALDH1A1KCNJ6
SCHEMBL9208767 0.74 RAB9A (0.46) NPC1RAB9ALMNACTSKSMN1; SMN2
SCHEMBL11346948 0.73 KMT2A (0.38) NPC1RAB9ALMNACTSKMEN1
SCHEMBL10529570 0.73 NPC1 (0.46) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL28385947 0.73 RAB9A (0.40) NPC1RAB9ALMNACTSKMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5013354-A Tetrahydrophthalimido group, herbicides BASF AKTIENGESELLSCHAFT (DE) 1991-05-07 US disclosed
EP-0300398-A2 3-Phenylpropionic acid derivatives BASF Aktiengesellschaft (DE) 1989-01-25 EP disclosed