SCHEMBL9243117

SCHEMBL9243117

Cc1ccc(C(=O)OO)c(C(=O)OO)c1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.37
METAP2 P50579 1/20 0.36
POLB P06746 2/20 0.33
MEN1 O00255 2/20 0.32
HSD17B10 Q99714 1/20 0.32
RAB9A P51151 4/20 0.32
NPC1 O15118 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
CASP3 P42574 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
ATM Q13315 1/20 0.32
HPGD P15428 1/20 0.32
NCEH1 Q6PIU2 1/20 0.32
TSHR P16473 1/20 0.31
MAPT P10636 2/20 0.30
LMNA P02545 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL28455094 0.83 POLB (0.35) KMT2APOLBMEN1RAB9ANPC1
SCHEMBL773572 0.80 ALDH1A1 (0.46) KMT2APOLBMEN1HSD17B10ATM
Ammonia Solution, Strong SCHEMBL9396736 0.78 ALDH1A1 (0.45) KMT2APOLBMEN1HSD17B10ATM
SCHEMBL28760512 0.78 TSHR (0.38) KMT2AMEN1HSD17B10RAB9ANPC1
SCHEMBL301812 0.77 TSHR (0.55) KMT2AMEN1HSD17B10SMN1; SMN2HPGD
SCHEMBL9157077 0.73 KMT2A (0.49) KMT2APOLBMEN1HSD17B10RAB9A
SCHEMBL3969049 0.73 CA12 (0.42) KMT2AMETAP2POLBMEN1HSD17B10
SCHEMBL3686834 0.73 HPGD (0.50) KMT2APOLBMEN1HSD17B10RAB9A
SCHEMBL29026677 0.72 CA12 (0.45) POLBNPC1HPGDMAPTLMNA
SCHEMBL28858015 0.72 GRM6 (0.40) HSD17B10ATMHPGDTSHRMAPT

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
CN-102612509-A Fluoroether functionalized aromatic diesters and derivatives thereof DU PONT 2012-07-25 CN disclosed
CN-102612529-A Polyesters comprising fluorovinyl ether functionalized aromatic moieties DU PONT 2012-07-25 CN disclosed
CN-102597060-A Aramid comprising fluorovinyl ether functionalized aromatic moiety DU PONT 2012-07-18 CN disclosed
CN-102575029-A Polyester film with improved oil repellency DU PONT 2012-07-11 CN disclosed
US-5391619-A Containing organic peroxide; impact strength PHILLIPS PETROLEUM COMPANY (US) 1995-02-21 US disclosed