SCHEMBL29919717

SCHEMBL29919717

Clc1cc(Nc2ccccn2)ncn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.50
MAPK10 P53779 1/20 0.50
GFER P55789 1/20 0.50
KMT2A Q03164 1/20 0.50
CCNE1 P24864 1/20 0.50
CDK2 P24941 1/20 0.50
HSF1 Q00613 1/20 0.50
LCK P06239 1/20 0.48
NPC1 O15118 1/20 0.47
KDR P35968 1/20 0.46
JAK2 O60674 2/20 0.46
JAK1 P23458 2/20 0.46
TYK2 P29597 2/20 0.46
ABL1 P00519 1/20 0.46
EGFR P00533 1/20 0.45
ERBB3 P21860 1/20 0.45
SMARCA2 P51531 1/20 0.44
SMARCA4 P51532 1/20 0.44
GRM5 P41594 1/20 0.44
JAK3 P52333 1/20 0.43

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
SCHEMBL28936188 1.00 MEN1 (0.50) MEN1MAPK10GFERKMT2ACCNE1
SCHEMBL10172152 0.79 NPC1 (0.47) MEN1KMT2ANPC1JAK2TYK2
SCHEMBL29391624 0.78 KMT2A (0.76) MEN1MAPK10GFERKMT2ANPC1
SCHEMBL221242 0.78 KMT2A (0.76) MEN1MAPK10GFERKMT2ANPC1
SCHEMBL857502 0.78 NPC1 (0.63) MEN1KMT2ACDK2NPC1EGFR
SCHEMBL16926547 0.78 MEN1 (0.53) MEN1MAPK10GFERKMT2ANPC1
SCHEMBL4595845 0.77 KMT2A (0.48) MEN1MAPK10GFERKMT2ACDK2
SCHEMBL29919765 0.77 NPC1 (0.46) MEN1KMT2ANPC1JAK2TYK2
SCHEMBL28936138 0.77 NPC1 (0.46) MEN1KMT2ANPC1JAK2TYK2
SCHEMBL31247411 0.77 NPC1 (0.50) MEN1KMT2ALCKNPC1KDR

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-20220289719-A1 HETEROCYCLIC COMPOUNDS AS MNK INHIBITORS NANJING INNOCARE PHARMA TECH CO., LTD. (CN) 2022-09-15 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-20220289719-A1 HETEROCYCLIC COMPOUNDS AS MNK INHIBITORS NIM1K, MAP3K1, MAPKAPK2 MEN1 491/4885MAPK10 55/4885GFER 4855/4885

“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.