SCHEMBL23009236

SCHEMBL23009236

CCc1nc(NC(=N)N)nc2cc(C)ccc12

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.43
MEN1 O00255 5/20 0.43
KDM4E B2RXH2 5/20 0.43
ALOX12 P18054 1/20 0.41
ALDH1A1 P00352 6/20 0.40
MAPT P10636 4/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
GAA P10253 2/20 0.39
LMNA P02545 4/20 0.38
TP53 P04637 1/20 0.38
GRM2 Q14416 3/20 0.36
KCNH2 Q12809 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
POLB P06746 1/20 0.35
RAD52 P43351 1/20 0.35
NPY2R P49146 1/20 0.34
ADORA3 P0DMS8 1/20 0.34
ADORA1 P30542 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
SCHEMBL12942514 0.89 ALDH1A1 (0.47) KMT2AMEN1KDM4EALDH1A1MAPT
SCHEMBL24029280 0.83 KDM4E (0.43) KMT2AMEN1KDM4EALDH1A1MAPT
SCHEMBL3469723 0.83 KMT2A (0.58) KMT2AMEN1KDM4EALOX12ALDH1A1
SCHEMBL7052702 0.77 GRM2 (0.40) KMT2AMEN1KDM4EALDH1A1MAPT
SCHEMBL6695252 0.76 KDM4E (0.54) KMT2AMEN1KDM4EALDH1A1MAPT
SCHEMBL7056204 0.76 LMNA (0.50) KMT2AMEN1KDM4EALOX12ALDH1A1
SCHEMBL3470444 0.74 KDM4E (0.58) KMT2AMEN1KDM4EALOX12ALDH1A1
SCHEMBL7052739 0.71 F2 (0.48) KMT2AMEN1KDM4EALDH1A1MAPT
SCHEMBL26173847 0.71 NPSR1 (0.43) KMT2AKDM4EALDH1A1MAPTNPC1
SCHEMBL2330079 0.70 ALDH1A1 (0.56) KMT2AMEN1KDM4EALOX12ALDH1A1

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-20210045387-A1 COMPOSITIONS AND METHODS TO INHIBIT ARTHROPOD HOST-SEEKING BEHAVIOR THE ROCKEFELLER UNIVERSITY (US) 2021-02-18 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-20210045387-A1 COMPOSITIONS AND METHODS TO INHIBIT ARTHROPOD HOST-SEEKING BEHAVIOR CHIA, CFH, C5 KMT2A 2355/4885MEN1 2088/4885KDM4E 3506/4885

“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.