SCHEMBL21967409

SCHEMBL21967409

Clc1ccc(Nc2nc(Br)nc3c2ncn3C2CCCCO2)cc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 10/20 0.64
YTHDC1 Q96MU7 1/20 0.57
CYP1A2 P05177 2/20 0.48
PDGFRA P16234 1/20 0.48
CCNE1 P24864 1/20 0.48
CDK2 P24941 1/20 0.48
TSHR P16473 1/20 0.48
NPC1 O15118 2/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CYP2C19 P33261 1/20 0.45
HPGD P15428 1/20 0.42

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
SCHEMBL21967196 0.97 FLT3 (0.59) FLT3YTHDC1CYP1A2PDGFRACCNE1
SCHEMBL21967885 0.92 FLT3 (0.74) FLT3YTHDC1PDGFRACCNE1CDK2
SCHEMBL21967753 0.91 FLT3 (0.65) FLT3YTHDC1PDGFRACCNE1CDK2
SCHEMBL21967445 0.90 FLT3 (0.64) FLT3YTHDC1NPC1RAB9ASMN1; SMN2
SCHEMBL21967507 0.90 FLT3 (0.64) FLT3YTHDC1PDGFRACCNE1CDK2
SCHEMBL21967560 0.90 YTHDC1 (0.71) FLT3YTHDC1CYP1A2PDGFRACCNE1
SCHEMBL21967668 0.89 FLT3 (0.59) FLT3YTHDC1CYP1A2PDGFRACCNE1
SCHEMBL21967579 0.89 FLT3 (0.69) FLT3YTHDC1CCNE1CDK2NPC1
SCHEMBL21967854 0.88 YTHDC1 (0.56) FLT3YTHDC1CYP1A2PDGFRACCNE1
SCHEMBL21967801 0.88 FLT3 (0.58) FLT3YTHDC1CYP1A2PDGFRACCNE1

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-10662194-B2 Substituted 6-anilino-9-heterocyclylpurine derivatives for inhibition of plant stress UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2020-05-26 US claimed

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-10662194-B2 Substituted 6-anilino-9-heterocyclylpurine derivatives for inhibition of plant stress TPMT, MTAP, ATIC FLT3 2877/4885YTHDC1 384/4885CYP1A2 220/4885

“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.