SCHEMBL6480960

SCHEMBL6480960

O=C(NCc1ncc(I)cc1Cl)c1c(Cl)ccnc1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
HPGD P15428 5/20 0.35
ALDH1A1 P00352 4/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
P2RX7 Q99572 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2C19 P33261 2/20 0.33
PTGES O14684 1/20 0.33
SCN2A Q99250 1/20 0.33
SCN10A Q9Y5Y9 1/20 0.33
TSHR P16473 1/20 0.33
NPC1 O15118 2/20 0.33
MAPK1 P28482 1/20 0.32
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
TYK2 P29597 1/20 0.32

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
SCHEMBL6030405 0.87 P2RX7 (0.43) POLBHPGDALDH1A1LMNASMN1; SMN2
SCHEMBL68385 0.85 POLB (0.40) POLBHPGDALDH1A1LMNASMN1; SMN2
SCHEMBL6031065 0.82 KMT2A (0.51) ALDH1A1SMN1; SMN2MEN1KMT2ACYP1A2
SCHEMBL7062611 0.81 EGFR (0.32) ALDH1A1LMNASMN1; SMN2KMT2APTGES
SCHEMBL6481161 0.81 MEN1 (0.39) POLBHPGDALDH1A1SMN1; SMN2MEN1
SCHEMBL4614052 0.80 KMT2A (0.39) POLBHPGDALDH1A1LMNASMN1; SMN2
SCHEMBL6901764 0.76 P2RX7 (0.40) POLBLMNASMN1; SMN2MEN1KMT2A
SCHEMBL4614047 0.74 CNR2 (0.35) POLBHPGDALDH1A1LMNASMN1; SMN2
SCHEMBL5565736 0.74 POLB (0.42) POLBHPGDALDH1A1LMNASMN1; SMN2
SCHEMBL319697 0.74 KMT2A (0.41) POLBHPGDSMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050020643-A1 Pyridinyl amides and compositions thereof for use as fungicides E.I. DU PONT DE NEMOURS AND COMPANY 2005-01-27 US 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-20050020643-A1 Pyridinyl amides and compositions thereof for use as fungicides ME3, CYC1, ME2 POLB 1386/4885HPGD 1230/4885ALDH1A1 1201/4885

“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.