SCHEMBL28048004

SCHEMBL28048004

Clc1ccc(Cl)nc1.O=CCl

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.45
KCNQ3 O43525 1/20 0.43
KCNQ2 O43526 1/20 0.43
KCNE1 P15382 1/20 0.43
KCNQ1 P51787 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PIK3CD O00329 1/20 0.40
NFE2L2 Q16236 1/20 0.40
PTK2 Q05397 1/20 0.39
POLB P06746 1/20 0.39
EGFR P00533 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ADRA2A P08913 2/20 0.38
ADRA2B P18089 2/20 0.38
ADRA2C P18825 2/20 0.38
PLAU P00749 1/20 0.38
CYP2A6 P11509 1/20 0.38

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
Formic Acid SCHEMBL28844167 0.91 NAPRT (0.47) NAPRTKCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL29538085 0.89
SCHEMBL17800 0.89
Formic Acid SCHEMBL28190349 0.89 NAPRT (0.45) NAPRTKCNQ3KCNQ2KCNE1KCNQ1
Formic Acid SCHEMBL28190351 0.89 SMN1; SMN2 (0.42) NAPRTKCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL32681750 0.87
Ammonia Solution, Strong SCHEMBL14636438 0.87
Methylamine SCHEMBL27656685 0.82 PIK3CD (0.46) NAPRTKCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL18343594 0.82 PIK3CD (0.41) NAPRTKCNQ3KCNQ2KCNE1KCNQ1
Boric Acid SCHEMBL28809555 0.80 NAPRT (0.45) NAPRTKCNQ3KCNQ2KCNE1KCNQ1

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-105358555-B Condensed heterocyclic compound and pest control use thereof 住友化学株式会社 2018-01-30 CN disclosed
CN-105358555-A Condensed heterocyclic compound and pest control use thereof SUMITOMO CHEMICAL CO 2016-02-24 CN disclosed