SCHEMBL23766634

SCHEMBL23766634

CCC(C)(C)c1cccc(OC(F)(F)C(F)(F)C(C)(CC)CC)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
CYP2C9 P11712 2/20 0.38
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
LMNA P02545 3/20 0.36
MAPK1 P28482 1/20 0.36
CASP3 P42574 1/20 0.36
ATM Q13315 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
KIF11 P52732 1/20 0.35
MAPT P10636 1/20 0.34
BRAF P15056 1/20 0.34
USP2 O75604 1/20 0.33
HTT P42858 1/20 0.33
CETP P11597 3/20 0.33
PKM P14618 1/20 0.32

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
SCHEMBL25875779 0.90 L3MBTL1 (0.36) CYP2C9L3MBTL1LMNAKIF11CETP
SCHEMBL21791776 0.89 NPC1 (0.39) NPC1RAB9ACYP2C9POLBL3MBTL1
SCHEMBL23766643 0.83 NPC1 (0.47) NPC1RAB9AMAPTMAOB
SCHEMBL17552755 0.82 KIF11 (0.49) NPC1RAB9ACYP2C9POLBL3MBTL1
SCHEMBL12464283 0.79 NPC1 (0.44) NPC1RAB9ACYP2C9POLBL3MBTL1
SCHEMBL15356141 0.77 NPC1 (0.43) NPC1RAB9ACYP2C9POLBL3MBTL1
SCHEMBL15356135 0.77 NPC1 (0.43) NPC1RAB9ACYP2C9POLBL3MBTL1
SCHEMBL3435840 0.75 KIF11 (0.46) NPC1RAB9ACYP2C9POLBLMNA
SCHEMBL13191971 0.74 TP53 (0.52) NPC1RAB9ACYP2C9POLBL3MBTL1
SCHEMBL15356133 0.73 NPC1 (0.40) NPC1RAB9ACYP2C9POLBL3MBTL1

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-20210253786-A1 FLUORINATED AROMATIC POLYMER AND METHOD FOR PRODUCING SAME DAIKIN INDUSTRIES, LTD. (JP) 2021-08-19 US disclosed