SCHEMBL10019102

SCHEMBL10019102

CCCCCC1(CCF)c2ccccc2-c2c1ccc1ccccc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.34
GAA P10253 5/20 0.33
KDM4E B2RXH2 4/20 0.33
NPC1 O15118 4/20 0.33
ALDH1A1 P00352 4/20 0.33
HTT P42858 4/20 0.33
RAB9A P51151 4/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
TDP1 Q9NUW8 3/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GLA P06280 1/20 0.33
RCE1 Q9Y256 1/20 0.33
KCNH2 Q12809 1/20 0.32
NPSR1 Q6W5P4 2/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
HPGD P15428 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
SCHEMBL3368133 0.92 CNR1 (0.39) CNR1GAAKDM4ENPC1ALDH1A1
SCHEMBL10019101 0.85 TDP1 (0.36) CNR1GAATDP1L3MBTL1KCNH2
SCHEMBL10019088 0.84 PDK2 (0.31) PDK2
SCHEMBL10019096 0.83 SLC6A4 (0.33) CNR1CYP2D6PDK2
SCHEMBL15870953 0.78 CNR1 (0.37) CNR1GAAKDM4ENPC1ALDH1A1
SCHEMBL20407353 0.75 CNR1 (0.34) CNR1GAAKDM4ENPC1ALDH1A1
SCHEMBL30655466 0.74 APEX1 (0.48) KDM4ETDP1MEN1KMT2AL3MBTL1
SCHEMBL83466 0.74 APEX1 (0.48) KDM4ETDP1MEN1KMT2AL3MBTL1
SCHEMBL6060689 0.73 APEX1 (0.47) GAATDP1MEN1KMT2AL3MBTL1
SCHEMBL14736023 0.73 APEX1 (0.47) GAATDP1MEN1KMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142855-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH PATENTS & SCIENTIFIC INFORMATION (DE) 2012-06-07 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-20120142855-A1 MATERIALS FOR ELECTRONIC DEVICES PEF1, PARG, EFNA1 CNR1 4299/4885GAA 1967/4885KDM4E 1594/4885

“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.