SCHEMBL15977916

SCHEMBL15977916

c1ccc(-c2ccc(-c3ccc4c(-c5ccc6c(c5)C5(CCCC5)c5ccccc5-6)c5ccccc5c(-c5ccc6c(c5)C5(CCCC5)c5ccccc5-6)c4c3)cn2)nc1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 4/20 0.38
NPY5R Q15761 1/20 0.35
CNR2 P34972 1/20 0.33
HPGDS O60760 1/20 0.33
CTSD P07339 1/20 0.32
BACE1 P56817 1/20 0.32
NR1I2 O75469 1/20 0.32
HSD11B1 P28845 1/20 0.32
METAP1 P53582 1/20 0.31
PDE5A O76074 1/20 0.30
PDE1A P54750 1/20 0.30
PDE1B Q01064 1/20 0.30
PDE4D Q08499 1/20 0.30
PDE7A Q13946 1/20 0.30
PDE1C Q14123 1/20 0.30
PDE3A Q14432 1/20 0.30
ALOX5AP P20292 1/20 0.30
FEN1 P39748 1/20 0.30

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
SCHEMBL15977573 0.99 PDK2 (0.38) PDK2NPY5RCNR2HPGDSCTSD
SCHEMBL15977814 0.94 PDK2 (0.43) PDK2NPY5RCNR2NR1I2HSD11B1
SCHEMBL15977594 0.93 PDK2 (0.42) PDK2NPY5RCNR2NR1I2HSD11B1
SCHEMBL15977673 0.90 PDK2 (0.43) PDK2NPY5RCNR2NR1I2HSD11B1
SCHEMBL15977933 0.88 PDK2 (0.43) PDK2NPY5RNR1I2HSD11B1METAP1
SCHEMBL15977808 0.87 PDK2 (0.44) PDK2NPY5RNR1I2HSD11B1PDE5A
SCHEMBL15977540 0.87 PDK2 (0.38) PDK2NPY5RALOX5AP
SCHEMBL15977921 0.86 PDK2 (0.43) PDK2NPY5RNR1I2HSD11B1PDE5A
SCHEMBL15977575 0.86 PDK2 (0.42) PDK2CNR2HPGDSCTSDBACE1
SCHEMBL15977735 0.86 PDK2 (0.43) PDK2NPY5RNR1I2HSD11B1PDE5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220416178-A1 COMPOSITION, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO.,LTD. (JP) 2022-12-29 US disclosed
US-9559311-B2 Anthracene derivative, organic-electroluminescence-device material, organic electroluminescence device, and electronic equipment IDEMITSU KOSAN CO., LTD. (JP) 2017-01-31 US disclosed
US-9559311-B2 Anthracene derivative, organic-electroluminescence-device material, organic electroluminescence device, and electronic equipment IDEMITSU KOSAN CO., LTD. (JP) 2017-01-31 US disclosed
US-20140239273-A1 ANTHRACENE DERIVATIVE, ORGANIC-ELECTROLUMINESCENCE-DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC EQUIPMENT IDEMITSU KOSAN CO., LTD. (JP) 2014-08-28 US disclosed
US-20140239273-A1 ANTHRACENE DERIVATIVE, ORGANIC-ELECTROLUMINESCENCE-DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC EQUIPMENT IDEMITSU KOSAN CO., LTD. (JP) 2014-08-28 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-20220416178-A1 COMPOSITION, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC APPARATUS PIEZO1, TMEM109, SLC39A14 PDK2 924/4885NPY5R 4572/4885CNR2 4512/4885

“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.