SCHEMBL28041401

SCHEMBL28041401

CCCCCCCCCCCCCCCCC(Cl)(OC)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EBP Q15125 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
HSP90AA1 P07900 1/20 0.38
CNR1 P21554 2/20 0.38
CNR2 P34972 2/20 0.38
SCN5A Q14524 3/20 0.38
SCN9A Q15858 3/20 0.38
DNM1 Q05193 2/20 0.38
MEN1 O00255 1/20 0.37
TP53 P04637 1/20 0.37
MAPK1 P28482 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
EPHX2 P34913 1/20 0.37
PKM P14618 1/20 0.37
CETP P11597 3/20 0.36
GPR55 Q9Y2T6 1/20 0.36
KCNH2 Q12809 1/20 0.36

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
SCHEMBL28310010 0.80 LTA4H (0.40) EBPSIGMAR1CNR1DNM1MEN1
SCHEMBL15658927 0.79 CNR1 (0.40) EBPSIGMAR1CNR1CNR2SCN5A
SCHEMBL15656054 0.79 CNR1 (0.40) EBPSIGMAR1CNR1CNR2SCN5A
SCHEMBL6684931 0.78 HSP90AA1 (0.41) EBPSIGMAR1HSP90AA1CNR1CNR2
SCHEMBL6682924 0.78 HSP90AA1 (0.41) EBPSIGMAR1HSP90AA1CNR1CNR2
SCHEMBL8673280 0.78 HSP90AA1 (0.41) EBPSIGMAR1HSP90AA1CNR1CNR2
SCHEMBL7524621 0.77 TSHR (0.42) MEN1MAPK1KMT2A
Ammonia Solution, Strong SCHEMBL11757631 0.77 HSP90AA1 (0.40) EBPSIGMAR1HSP90AA1CNR1CNR2
SCHEMBL28098831 0.77 CNR2 (0.42) EBPSIGMAR1HSP90AA1CNR1CNR2
SCHEMBL15656479 0.77 LTA4H (0.38) EBPSIGMAR1CNR1CNR2MEN1

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-106086848-B A kind of acid-washing stainless steel passivating solution and preparation method thereof and application method 东莞市凯盟表面处理技术开发有限公司 2018-08-21 CN disclosed
CN-106086848-A A kind of acid-washing stainless steel passivating solution and preparation method thereof and using method 东莞市凯盟表面处理技术开发有限公司 2016-11-09 CN disclosed
CN-103820796-B A kind of environmental protection pickling agent for stainless steel of nonnitrogenous, phosphoric and application method thereof DONGGUAN KAIMENG SURFACE TREATMENT TECHNOLOGY DEVELOPMENT LIMITED COMPANY (CN) 2016-01-13 CN disclosed