SCHEMBL13348652

SCHEMBL13348652

CCCCOc1nc(OC)nc2ccc(Cl)nc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
MCHR1 Q99705 2/20 0.33
HSD17B10 Q99714 2/20 0.33
CCR4 P51679 1/20 0.32
PDE2A O00408 1/20 0.32
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32
ALDH1A1 P00352 4/20 0.32
TSHR P16473 3/20 0.32
KDM4E B2RXH2 3/20 0.32
HTT P42858 2/20 0.32
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL13348656 0.86 MCHR1 (0.48) SMN1; SMN2NPC1RAB9ACYP1A2CYP2C9
SCHEMBL13348647 0.79 TLR8 (0.42) SMN1; SMN2NPC1RAB9ACYP1A2CYP2C9
SCHEMBL13313397 0.78 L3MBTL1 (0.43) MAT2ASMN1; SMN2ALDH1A1TSHRKDM4E
SCHEMBL13348657 0.76 KDM4E (0.32) ALDH1A1KDM4EHTTMAPTMEN1
SCHEMBL13348572 0.75 MCHR1 (0.36) SMN1; SMN2NPC1RAB9ACYP1A2CYP2C9
SCHEMBL4114488 0.75 MAPK8 (0.40) SMN1; SMN2NPC1RAB9ACYP1A2CYP2C9
SCHEMBL826312 0.74 CDK1 (0.43) NPC1RAB9ACYP1A2MCHR1HSD17B10
SCHEMBL4108612 0.71 MAPK8 (0.37) CYP1A2KDM4EMAPTMEN1KMT2A
SCHEMBL823730 0.70 TSHR (0.43) TSHRTLR8
SCHEMBL13271236 0.69 MCHR1 (0.38) SMN1; SMN2NPC1RAB9AMCHR1HSD17B10

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-20100160346-A1 NEUROLOGICALLY ACTIVE COMPOUNDS PRANA BIOTECHNOLOGY LIMITED (AU) 2010-06-24 US disclosed
US-7692011-B2 8-hydroxy and 8-mercapto quinazolinones PRANA BIOTECHNOLOGY LIMITED (AU) 2010-04-06 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-20100160346-A1 NEUROLOGICALLY ACTIVE COMPOUNDS ACHE, PSEN1, PSEN2 MAT2A 3310/4885SMN1; SMN2 20/4885NPC1 236/4885

“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.