SCHEMBL17845526

SCHEMBL17845526

CSc1nc(Nc2ccccc2)c2ncn(C3CCCCO3)c2n1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 6/20 0.56
YTHDC1 Q96MU7 1/20 0.53
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
CYP2C19 P33261 1/20 0.47
SRC P12931 5/20 0.46
PDGFRA P16234 1/20 0.46
CDK2 P24941 1/20 0.46
ADORA3 P0DMS8 2/20 0.40
ADORA2A P29274 2/20 0.40
ADORA1 P30542 2/20 0.40
HCK P08631 1/20 0.40
PIM1 P11309 1/20 0.40
SCTR P47872 1/20 0.40

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
SCHEMBL21967428 0.91 FLT3 (0.57) FLT3YTHDC1NPC1RAB9ASMN1; SMN2
SCHEMBL21967350 0.91 FLT3 (0.51) FLT3YTHDC1NPC1RAB9ASMN1; SMN2
SCHEMBL21967679 0.90 FLT3 (0.56) FLT3YTHDC1NPC1RAB9ASMN1; SMN2
SCHEMBL21967498 0.90 FLT3 (0.69) FLT3YTHDC1NPC1RAB9ASMN1; SMN2
SCHEMBL21967225 0.90 YTHDC1 (0.57) FLT3YTHDC1NPC1RAB9ASMN1; SMN2
SCHEMBL21967789 0.90 FLT3 (0.56) FLT3YTHDC1NPC1RAB9ASMN1; SMN2
SCHEMBL21967649 0.89 FLT3 (0.49) FLT3YTHDC1NPC1RAB9ASMN1; SMN2
SCHEMBL21967755 0.89 FLT3 (0.49) FLT3YTHDC1NPC1RAB9ASMN1; SMN2
SCHEMBL21967125 0.89 FLT3 (0.56) FLT3YTHDC1NPC1RAB9ASMN1; SMN2
SCHEMBL21967855 0.89 FLT3 (0.55) FLT3YTHDC1NPC1RAB9ASMN1; SMN2

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 5 patents. 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 disclosed
EP-3233860-B1 SUBSTITUTED 6-ANILINO-9-HETEROCYCLYLPURINE DERIVATIVES FOR INHIBITION OF PLANT STRESS UNIV PALACKEHO (CZ) 2020-01-29 EP disclosed
US-20170342072-A1 SUBSTITUTED 6-ANILINO-9-HETEROCYCLYLPURINE DERIVATIVES FOR INHIBITION OF PLANT STRESS UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2017-11-30 US disclosed
EP-3233860-A1 SUBSTITUTED 6-ANILINO-9-HETEROCYCLYLPURINE DERIVATIVES FOR INHIBITION OF PLANT STRESS Univerzita Palackého V Olomouci (CZ) 2017-10-25 EP disclosed
WO-2016095881-A1 SUBSTITUTED 6-ANILINO-9-HETEROCYCLYLPURINE DERIVATIVES FOR INHIBITION OF PLANT STRESS UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2016-06-23 WO 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 (2 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 384/4885NPC1 3926/4885
US-20170342072-A1 SUBSTITUTED 6-ANILINO-9-HETEROCYCLYLPURINE DERIVATIVES FOR INHIBITION OF PLANT STRESS TPMT, MTAP, ATIC FLT3 2877/4885YTHDC1 384/4885NPC1 3926/4885

“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.