SCHEMBL9745633

SCHEMBL9745633

C=C(CF)C(=O)Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.45
TDP1 Q9NUW8 2/20 0.40
ATM Q13315 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ALOX15 P16050 3/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP19A1 P11511 1/20 0.39
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
NSD2 O96028 1/20 0.37
PKM P14618 1/20 0.35
ALDH1A1 P00352 1/20 0.35
THRB P10828 1/20 0.35

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
SCHEMBL824141 0.82 ELANE (0.46) ELANETDP1ATML3MBTL1ALOX15
SCHEMBL11710172 0.81 ELANE (0.42) ELANETDP1ATML3MBTL1ALOX15
SCHEMBL27497732 0.81 ELANE (0.45) ELANETDP1ATML3MBTL1ALOX15
SCHEMBL544812 0.81 ELANE (0.45) ELANETDP1ATML3MBTL1ALOX15
SCHEMBL8581933 0.81 ELANE (0.45) ELANETDP1ATML3MBTL1ALOX15
SCHEMBL11243154 0.81 ELANE (0.45) ELANETDP1ATML3MBTL1ALOX15
SCHEMBL434641 0.81 ELANE (0.49) ELANETDP1ATML3MBTL1ALOX15
SCHEMBL9746065 0.81 ELANE (0.45) ELANETDP1ATML3MBTL1ALOX15
SCHEMBL1520832 0.81 ELANE (0.45) ELANETDP1ATML3MBTL1ALOX15
SCHEMBL528297 0.81 ELANE (0.45) ELANETDP1ATML3MBTL1ALOX15

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
CN-103917622-A Proppant materials and methods of tailoring proppant material surface wettability MOMENTIVE SPECIALTY CHEM INC 2014-07-09 CN disclosed
US-5100762-A Radiation-sensitive polymer and radiation-sensitive composition containing the same MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1992-03-31 US disclosed