SCHEMBL10071025

SCHEMBL10071025

COC(=O)c1cnn2cc(F)cnc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
PDE2A O00408 10/20 0.42
ALDH1A1 P00352 4/20 0.42
HPGD P15428 4/20 0.42
HSD17B10 Q99714 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
TSHR P16473 1/20 0.42
CASP1 P29466 1/20 0.42
STING1 Q86WV6 1/20 0.41
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
IRAK4 Q9NWZ3 1/20 0.39
KDM4E B2RXH2 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PDE3A Q14432 1/20 0.39
PDE10A Q9Y233 1/20 0.39

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
SCHEMBL309140 0.84 ALDH1A1 (0.55) LMNAPDE2AALDH1A1HPGDHSD17B10
SCHEMBL19045790 0.83 PDE2A (0.57) LMNAPDE2AALDH1A1HPGDHSD17B10
SCHEMBL19029896 0.82 PDE2A (0.45) LMNAPDE2AALDH1A1HPGDHSD17B10
SCHEMBL309283 0.82 KDM4E (0.43) PDE2AALDH1A1JAK2JAK1IRAK4
SCHEMBL19029939 0.82 LMNA (0.47) LMNAPDE2AALDH1A1HPGDHSD17B10
SCHEMBL308924 0.81 KDM4E (0.42) PDE2AALDH1A1JAK2JAK1IRAK4
SCHEMBL15778762 0.80 PDE2A (0.41) PDE2AALDH1A1HPGDHSD17B10L3MBTL1
Lithium Ion SCHEMBL308923 0.78 PDE2A (0.40) PDE2AALDH1A1HPGDJAK2JAK1
SCHEMBL29585395 0.76 IRAK4 (0.44) LMNAALDH1A1HPGDHSD17B10L3MBTL1
SCHEMBL31547134 0.75 POLB (0.39) LMNAALDH1A1HPGDHSD17B10L3MBTL1

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-8093249-B2 Pyrazolo[1,5-A]pyrimidine-carbonyl-piperazine derivatives Convergence Pharmaceuticals Limited (GB) 2012-01-10 US disclosed
US-20100016330-A1 Novel Derivatives Convergence Pharmaceuticals Limited (GB) 2010-01-21 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-20100016330-A1 Novel Derivatives CACNB2, CACNA1B, CACNA1D LMNA 1760/4885PDE2A 660/4885ALDH1A1 3984/4885

“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.