SCHEMBL2586904

SCHEMBL2586904

Cc1cc(CNC=O)ccc1Br

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.46
ADH1C P00326 1/20 0.46
ADH1A P07327 1/20 0.46
ADH7 P40394 1/20 0.46
KMT2A Q03164 4/20 0.39
MEN1 O00255 2/20 0.39
ALDH1A1 P00352 4/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
RAB9A P51151 3/20 0.36
NPC1 O15118 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
PKM P14618 1/20 0.35
LMNA P02545 1/20 0.34

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
SCHEMBL16508324 0.83 ADH1B (0.50) ADH1BADH1CADH1AADH7MAPT
SCHEMBL5398523 0.83 ADH1B (0.50) ADH1BADH1CADH1AADH7ALDH1A1
Hydrochloric Acid SCHEMBL5385065 0.81 ADH1B (0.48) ADH1BADH1CADH1AADH7ALDH1A1
SCHEMBL3304927 0.79 HDAC3 (0.49) ADH1BADH1CADH1AADH7HDAC3
SCHEMBL2723303 0.77 ALDH1A1 (0.37) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL31672808 0.77 HTR7 (0.42) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL9300840 0.77 HTR7 (0.42) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL6904685 0.76 SKP2 (0.37) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL8763600 0.76 ADH1B (0.47) ADH1BADH1CADH1AADH7KMT2A
SCHEMBL17503952 0.76 ADH1B (0.43) ADH1BADH1CADH1AADH7

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10364235-B2 Insecticidal compounds Synenta Crop Protection LLC (US) 2019-07-30 US disclosed
US-10364235-B2 Insecticidal compounds Synenta Crop Protection LLC (US) 2019-07-30 US disclosed
US-20180065956-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2018-03-08 US disclosed
US-20180065956-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2018-03-08 US disclosed
US-20180065956-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2018-03-08 US disclosed
US-9834546-B2 Insecticidal compounds SYNGENTA LIMITED (GB) 2017-12-05 US disclosed
US-9834546-B2 Insecticidal compounds SYNGENTA LIMITED (GB) 2017-12-05 US disclosed
US-9834546-B2 Insecticidal compounds SYNGENTA LIMITED (GB) 2017-12-05 US disclosed
US-20170022187-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2017-01-26 US disclosed
US-20170022187-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2017-01-26 US disclosed
US-20130131137-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2013-05-23 US disclosed
US-20130131137-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2013-05-23 US disclosed
US-20130131137-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2013-05-23 US disclosed
CN-102803257-A Insecticidal Compounds SYNGENTA PARTICIPATIONS AG 2012-11-28 CN disclosed
US-20110269804-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2011-11-03 US disclosed
US-20110269804-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2011-11-03 US disclosed
US-20110269804-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2011-11-03 US disclosed
CN-102131804-A Insecticidal compounds SYNGENTA PARTICIPATIONS AG 2011-07-20 CN disclosed
WO-2010149506-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2010-12-29 WO disclosed
WO-2010020522-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2010-02-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170022187-A1 INSECTICIDAL COMPOUNDS ACHE, CHRM1, NIT2 ADH1B 1802/4885ADH1C 524/4885ADH1A 779/4885
US-20130131137-A1 INSECTICIDAL COMPOUNDS F5, CHRM1, CHRM2 ADH1B 2258/4885ADH1C 666/4885ADH1A 806/4885
US-10364235-B2 Insecticidal compounds ACHE, CHRM1, NIT2 ADH1B 1802/4885ADH1C 524/4885ADH1A 779/4885
US-20180065956-A1 INSECTICIDAL COMPOUNDS ACHE, CHRM1, NIT2 ADH1B 1802/4885ADH1C 524/4885ADH1A 779/4885
US-20110269804-A1 INSECTICIDAL COMPOUNDS CHRM1, CHRM2, C1R ADH1B 2201/4885ADH1C 1180/4885ADH1A 2305/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.