SCHEMBL17054072

SCHEMBL17054072

Cc1c(Nc2ccccc2)c(C(=O)Nc2ncnn2C)nn(C)c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
ALDH1A1 P00352 6/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 1/20 0.39
TSHR P16473 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KDM4E B2RXH2 3/20 0.38
MAPT P10636 1/20 0.38
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
CCNA1 P78396 1/20 0.38
POLB P06746 2/20 0.37
PKM P14618 1/20 0.37
AURKA O14965 1/20 0.36
TTK P33981 1/20 0.36
GAA P10253 2/20 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
SCHEMBL17054068 0.83 POLB (0.47) SMN1; SMN2PDE4APDE4BPDE4CPDE4D
SCHEMBL17427482 0.75 TYRO3 (0.38) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT
SCHEMBL17427483 0.67 RIPK1 (0.36) ALDH1A1KMT2AMEN1TSHRNPSR1
SCHEMBL19980639 0.65 GRM5 (0.33) SMN1; SMN2ALDH1A1KMT2AMEN1TSHR
SCHEMBL17427475 0.65 TYRO3 (0.41) KMT2AMEN1RAB9A
SCHEMBL23022737 0.62 L3MBTL1 (0.44) SMN1; SMN2ALDH1A1KMT2AMEN1KDM4E
SCHEMBL17409840 0.61 KMT2A (0.48) SMN1; SMN2ALDH1A1KMT2AKDM4EMAPT
SCHEMBL31735702 0.61 BRD4 (0.70)
SCHEMBL21246173 0.61 NR3C2 (0.35) ALDH1A1KMT2AMEN1TSHRNPSR1
SCHEMBL24400184 0.61 NTRK1 (0.48) ALDH1A1TSHRKDM4EMAPTPOLB

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3110809-B1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-03-21 EP disclosed
US-9701662-B2 Herbicidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2017-07-11 US disclosed
US-9701662-B2 Herbicidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2017-07-11 US disclosed
US-20170066745-A1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2017-03-09 US disclosed
US-20170066745-A1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2017-03-09 US disclosed
WO-2015128424-A1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2015-09-03 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 (1 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-20170066745-A1 HERBICIDAL COMPOUNDS DDT, HACL2, CBR3 SMN1; SMN2 4127/4885PDE4A 925/4885PDE4B 667/4885

“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.