SCHEMBL9785643

SCHEMBL9785643

Cc1cccc(C)c1C(=O)Oc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.51
RAB9A P51151 3/20 0.51
NPSR1 Q6W5P4 1/20 0.51
TDP1 Q9NUW8 3/20 0.50
KDM4E B2RXH2 1/20 0.50
PTK2B Q14289 1/20 0.49
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
HSD17B10 Q99714 1/20 0.48
KMT2A Q03164 3/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
NSD2 O96028 1/20 0.46
POLB P06746 1/20 0.45
ALDH1A1 P00352 2/20 0.44
NPC1 O15118 2/20 0.44
PTGS2 P35354 1/20 0.44
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL8423387 0.93 MAPT (0.47) MAPTRAB9ANPSR1TDP1KDM4E
SCHEMBL28972068 0.89 MAPT (0.57) MAPTRAB9ANPSR1TDP1KDM4E
SCHEMBL6125235 0.86 MAPT (0.50) MAPTRAB9ANPSR1TDP1KDM4E
SCHEMBL9282972 0.85 MAPT (0.49) MAPTRAB9ANPSR1TDP1KDM4E
SCHEMBL6125231 0.83 MAPT (0.51) MAPTRAB9ANPSR1TDP1KDM4E
Phosphine SCHEMBL28088577 0.83 MAPT (0.48) MAPTRAB9ANPSR1TDP1KDM4E
SCHEMBL15521372 0.82 MAPT (0.47) MAPTRAB9ANPSR1TDP1KDM4E
SCHEMBL11483411 0.81 KMT2A (0.46) MAPTNPSR1HPGDALOX15HSD17B10
SCHEMBL1254116 0.80 KMT2A (0.64) MAPTRAB9ATDP1KDM4EPTK2B
SCHEMBL30631651 0.79 MAPT (0.59) MAPTTDP1KDM4EPTK2BHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1094028-A Selective PDE enzyme (IV) inhibitor catechol diether class PFIZER (US) 1994-10-26 CN disclosed
US-5041169-A Comprising phenyl benzoate, solvent and activating agent, soldering printed circuit boards COOKSON GROUP PLC (GB) 1991-08-20 US disclosed
EP-0379290-A1 Flux composition COOKSON GROUP plc (GB) 1990-07-25 EP disclosed