SCHEMBL18019489

SCHEMBL18019489

Cc1nn(-c2cncnc2)cc1N(C)C(=O)NC1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.43
NR3C1 P04150 3/20 0.37
CNR2 P34972 5/20 0.37
CNR1 P21554 5/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
RAB9A P51151 1/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
P2RX7 Q99572 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
SCHEMBL18019543 0.78
SCHEMBL15363463 0.73 MAP3K5 (0.31)
SCHEMBL18019554 0.72 NPC1 (0.36) SMN1; SMN2RAB9A
SCHEMBL18019546 0.71 LMNA (0.32)
SCHEMBL14904644 0.71 PKM (0.30) PKMKMT2A
SCHEMBL17980256 0.71 IRAK4 (0.32)
SCHEMBL15356708 0.69
SCHEMBL18627095 0.67 GRM1 (0.40) RAB9AMEN1KMT2A
SCHEMBL16269898 0.67 NPC1 (0.41) PKMRAB9AKMT2A
SCHEMBL4973973 0.65 ELOVL1 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10905123-B2 Herbicidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2021-02-02 US disclosed
US-20180027815-A1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-02-01 US disclosed
US-20180027815-A1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-02-01 US disclosed
WO-2016128266-A1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-08-18 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 (2 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-20180027815-A1 HERBICIDAL COMPOUNDS DDT, HPD, PDXK PKM 313/4885NR3C1 3816/4885CNR2 2454/4885
US-10905123-B2 Herbicidal compounds DDT, HPD, PDXK PKM 313/4885NR3C1 3816/4885CNR2 2454/4885

“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.