SCHEMBL10272989

SCHEMBL10272989

CCc1cnc2cc(C)ccc2n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 1/20 0.47
MAPT P10636 5/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
EGFR P00533 1/20 0.42
LMNA P02545 1/20 0.42
MAPK1 P28482 1/20 0.42
PDE10A Q9Y233 1/20 0.41
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
CYP1A2 P05177 4/20 0.38
CYP2C9 P11712 1/20 0.37
HIF1A Q16665 1/20 0.37
HTR1A P08908 2/20 0.37
ADRA1D P25100 2/20 0.37
ADRA1A P35348 2/20 0.37
ADRA1B P35368 2/20 0.37

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
SCHEMBL10271472 0.93 NQO2 (0.47) NQO2MAPTRAB9ASMN1; SMN2NPC1
SCHEMBL29234175 0.84 NQO2 (0.46) NQO2MAPTRAB9ASMN1; SMN2NPC1
SCHEMBL19494307 0.81 NQO2 (0.43) NQO2MAPTRAB9ASMN1; SMN2NPC1
SCHEMBL13226945 0.80 PABPC1 (0.41) NQO2MAPTPDE10AALDH1A1CYP1A2
SCHEMBL10271340 0.80 HRH4 (0.51) MAPTPDE10AKDM4EALDH1A1CYP1A2
SCHEMBL12650516 0.78 CYP1A2 (0.44) NQO2MAPTRAB9ANPC1PDE10A
SCHEMBL14157791 0.77 PDE10A (0.50) MAPTPDE10AKDM4EALDH1A1TDP1
SCHEMBL20049320 0.77 PDE10A (0.43) MAPTRAB9ASMN1; SMN2NPC1LMNA
SCHEMBL10272593 0.77 ALDH1A1 (0.51) NQO2MAPTRAB9ASMN1; SMN2NPC1
SCHEMBL5792272 0.76 PDE10A (0.69) MAPTRAB9ASMN1; SMN2NPC1PDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3715340-A1 PESTICIDALLY ACTIVE SEMI-CARBAZONES AND THIOSEMICARBAZONES DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2020-09-30 EP disclosed
EP-3247702-B1 PESTICIDALLY ACTIVE SEMI-CARBAZONES AND THIOSEMICARBAZONES DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2020-04-22 EP disclosed
WO-2019149260-A1 PYRIDAZINOL COMPOUND, DERIVATIVE THEREOF, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF 青岛清原化合物有限公司 2019-08-08 WO disclosed
US-20120035189-A1 Quinuclidine Compounds as Alpha-7 Nicotinic Acetylcholine Receptor Ligands BRISTOL-MYERS SQUIBB COMPANY 2012-02-09 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-20120035189-A1 Quinuclidine Compounds as Alpha-7 Nicotinic Acetylcholine Receptor Ligands CHRNA7, CHRNA5, CHRNA6 NQO2 130/4885MAPT 268/4885RAB9A 333/4885

“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.