SCHEMBL24221968

SCHEMBL24221968

C=C(Nc1ccc(F)cc1)n1cccn1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 4/20 0.43
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
TAAR1 Q96RJ0 1/20 0.40
RAB9A P51151 3/20 0.38
TGM2 P21980 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
ALDH1A1 P00352 1/20 0.37
NPC1 O15118 2/20 0.37
NOX1 Q9Y5S8 1/20 0.37
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
IDO1 P14902 1/20 0.35
GAA P10253 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL24222000 0.84 PDE4B (0.43) PDE4BMEN1KMT2ARAB9ACYP1A2
SCHEMBL21883243 0.84 TDP1 (0.47) PDE4BMEN1KMT2AALDH1A1NOX1
SCHEMBL24221907 0.84 ALDH1A1 (0.44) PDE4BMEN1KMT2ARAB9ATGM2
SCHEMBL24221853 0.78 MEN1 (0.47) MEN1KMT2ARAB9ATGM2ALDH1A1
SCHEMBL21883217 0.74 FBP1 (0.47) MEN1KMT2ACYP1A2CYP2C19ALDH1A1
SCHEMBL24221933 0.74 KMT2A (0.46) PDE4BMEN1KMT2ARAB9ACYP1A2
SCHEMBL24221901 0.71 MAPT (0.46) PDE4BMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL18604415 0.68 ALDH1A1 (0.46) MEN1KMT2ARAB9ACYP1A2CYP2C19
SCHEMBL21883137 0.68 SMN1; SMN2 (0.49) PDE4BMEN1KMT2ARAB9ACYP1A2
SCHEMBL21883142 0.68 SMN1; SMN2 (0.49) PDE4BMEN1KMT2ACYP1A2CYP2C19

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-20220024877-A1 COMPOUNDS WITH COPPER- OR ZINC-ACTIVATED TOXICITY AGAINST MICROBIAL INFECTION THE UAB RESEARCH FOUNDATION 2022-01-27 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-20220024877-A1 COMPOUNDS WITH COPPER- OR ZINC-ACTIVATED TOXICITY AGAINST MICROBIAL INFECTION SLC39A11, CNBP, SLC39A3 PDE4B 4696/4885MEN1 1706/4885KMT2A 2961/4885

“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.