SCHEMBL1610098

SCHEMBL1610098

COC(=O)c1nc(C2CC2)nc(Nc2ccccc2)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 3/20 0.44
PDE10A Q9Y233 1/20 0.42
MAPT P10636 2/20 0.39
TP53 P04637 2/20 0.39
TSHR P16473 2/20 0.39
MAPK1 P28482 2/20 0.39
HPGD P15428 2/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
ALOX15 P16050 1/20 0.39
PDE4B Q07343 3/20 0.38
PDE4D Q08499 3/20 0.38
ABCC1 P33527 1/20 0.38
ABCG2 Q9UNQ0 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.37
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 1/20 0.37
SLC6A3 Q01959 1/20 0.37
LMNA P02545 3/20 0.36
CSNK2A1 P68400 1/20 0.36

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
SCHEMBL1610344 0.86 PDE10A (0.44) PDE10AMAPTTSHRMAPK1RAB9A
SCHEMBL1610313 0.85 SLC6A3 (0.43) MAPTRAB9ANPC1SLC6A3KDM4E
SCHEMBL11913414 0.84 SMN1; SMN2 (0.38) PDE10AMAPTTSHRMAPK1HPGD
SCHEMBL1609362 0.82 PDE10A (0.40) PDE10ATSHRMAPK1SMN1; SMN2ALDH1A1
SCHEMBL1609704 0.82 PDE10A (0.62) PDE5APDE10AHPGDPDE4BPDE4D
SCHEMBL1610314 0.81 PDE10A (0.44) PDE10ATP53TSHRMAPK1PDE4B
SCHEMBL1610170 0.81 PDE10A (0.50) PDE10AMAPTTP53TSHRMAPK1
SCHEMBL1610284 0.81 PDE10A (0.39) PDE10ATSHRMAPK1SMN1; SMN2ALDH1A1
SCHEMBL1609426 0.81 PDE10A (0.48) PDE10AMAPTTSHRMAPK1HPGD
SCHEMBL1609830 0.80 ELANE (0.40) PDE10ATSHRMAPK1ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 US disclosed
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 US disclosed
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 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-20110086759-A1 CHEMICAL COMPOUNDS DDT, PNPO, CBR3 PDE5A 1238/4885PDE10A 1704/4885MAPT 2800/4885

“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.