SCHEMBL26422707

SCHEMBL26422707

Cc1cc2c(C(F)F)cccn2c1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
GRM5 P41594 5/20 0.33
NPC1 O15118 2/20 0.32
NFKB1 P19838 2/20 0.32
RAB9A P51151 2/20 0.32
NFKB2 Q00653 2/20 0.32
RELA Q04206 2/20 0.32
GAA P10253 1/20 0.32
TP53 P04637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL26432056 0.79 KDM4E (0.32) ALDH1A1KDM4E
SCHEMBL26262661 0.78 KDM4E (0.33) ALDH1A1KDM4EGRM5
SCHEMBL26422702 0.76 ALDH1A1 (0.45) ALDH1A1KDM4EGRM5NPC1NFKB1
SCHEMBL7167679 0.75 ALDH1A1 (0.56) ALDH1A1KDM4EGRM5NPC1NFKB1
SCHEMBL23385228 0.72 ALDH1A1 (0.38) ALDH1A1KDM4EGRM5NPC1NFKB1
SCHEMBL16644707 0.72 GRM5 (0.38) ALDH1A1KDM4EGRM5NPC1NFKB1
SCHEMBL26422705 0.72 KDM4E (0.38) ALDH1A1KDM4EGRM5NPC1NFKB1
SCHEMBL16632648 0.72 ALDH1A1 (0.38) ALDH1A1KDM4EGRM5NPC1NFKB1
SCHEMBL7170576 0.71 ALDH1A1 (0.43) ALDH1A1KDM4EGRM5NPC1NFKB1
SCHEMBL7169178 0.66 TDP1 (0.44) ALDH1A1KDM4ENPC1RAB9AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230312481-A1 SUBSTITUTED (PHTHALAZIN-1-YLMETHYL)UREAS, SUBSTITUTED N-(PHTHALAZIN-1-YLMETHYL)AMIDES, AND ANALOGUES THEREOF ARBUTUS BIOPHARMA CORP (CA) 2023-10-05 US disclosed
US-20230312481-A1 SUBSTITUTED (PHTHALAZIN-1-YLMETHYL)UREAS, SUBSTITUTED N-(PHTHALAZIN-1-YLMETHYL)AMIDES, AND ANALOGUES THEREOF ARBUTUS BIOPHARMA CORP (CA) 2023-10-05 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-20230312481-A1 SUBSTITUTED (PHTHALAZIN-1-YLMETHYL)UREAS, SUBSTITUTED N-(PHTHALAZIN-1-YLMETHYL)AMIDES, AND ANALOGUES THEREOF NSD3, PML, NSD1 ALDH1A1 3447/4885KDM4E 133/4885GRM5 4042/4885

“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.