SCHEMBL16485488

SCHEMBL16485488

Cc1cc(F)c(C)c(C)c1F

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
RAPGEF4 Q8WZA2 1/20 0.32
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31

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
SCHEMBL2508266 0.82 RAPGEF4 (0.37) ACHERAPGEF4CES2CES1
SCHEMBL5391101 0.82 ACHE (0.33) ACHEHDAC1HDAC6RAPGEF4
SCHEMBL14327159 0.79 CES2 (0.38) HDAC1HDAC6RAPGEF4CES2CES1
SCHEMBL13980077 0.79 CYP3A4 (0.30)
SCHEMBL8847064 0.79 ACHE (0.35) ACHEHDAC1HDAC6RAPGEF4
SCHEMBL31633792 0.79 CYP3A4 (0.30)
Methyl Alcohol SCHEMBL28274625 0.78 POLB (0.36) ACHEHDAC1HDAC6RAPGEF4CES2
SCHEMBL16707523 0.78 CYP3A4 (0.33) ACHERAPGEF4
SCHEMBL13980078 0.77 ACHE (0.33) ACHEHDAC1HDAC6RAPGEF4
SCHEMBL13891480 0.77 RAPGEF4 (0.37) ACHERAPGEF4CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230132149-A1 ULTRA NARROW BANDGAP NON-FULLERENE-ACCEPTOR BASED ORGANIC ELECTRONICS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-04-27 US disclosed
EP-3266788-B1 METAL COMPLEX AND MANUFACTURING METHOD AND USAGE, DISPLAY DEVICE THEREOF BOE TECHNOLOGY GROUP CO LTD (CN) 2020-12-09 EP disclosed
US-9647218-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2017-05-09 US disclosed
US-20150129849-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2015-05-14 US disclosed
WO-2014057504-A1 POROUS CRYSTALLINE FRAMEWORKS, PROCESS FOR THE PREPARATION THEROF AND THEIR MECHANICAL DELAMINATION TO COVALENT ORGANIC NANOSHEETS (CONS) COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2014-04-17 WO disclosed