SCHEMBL22063390

SCHEMBL22063390

c1cc(-c2c3ccccc3c(-c3ccc4ccccc4c3)c3ccccc23)cc(-c2cccc3oc4ccccc4c23)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.40
▸ HDAC2 Q92769 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40
▸ GPR84 Q9NQS5 1/20 0.39
▸ GSTP1 P09211 1/20 0.39
▸ ALOX5 P09917 1/20 0.39
▸ PRKDC P78527 1/20 0.38
▸ MIF P14174 1/20 0.37
▸ HSD17B1 P14061 1/20 0.37
▸ HSD17B2 P37059 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ PLA2G2A P14555 2/20 0.37
▸ PLA2G4A P47712 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ CYP1A1 P04798 2/20 0.35
▸ CYP1B1 Q16678 1/20 0.35
▸ CASP3 P42574 1/20 0.35
▸ SENP7 Q9BQF6 1/20 0.35

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
SCHEMBL22062620 0.97 HDAC4 (0.42) HDAC4HDAC2HDAC8GPR84GSTP1
SCHEMBL17320738 0.95 HSD17B1 (0.39) HDAC4HDAC2HDAC8GPR84GSTP1
SCHEMBL22063079 0.93 HSD17B1 (0.40) HDAC4HDAC2HDAC8GPR84GSTP1
SCHEMBL23955081 0.93 L3MBTL1 (0.39) HDAC4HDAC2HDAC8GPR84GSTP1
SCHEMBL22062619 0.93 ALOX5 (0.40) HDAC4HDAC2HDAC8GPR84ALOX5
SCHEMBL17320741 0.93 L3MBTL1 (0.38) HDAC4HDAC2HDAC8GPR84GSTP1
SCHEMBL22950514 0.92 GPR84 (0.39) HDAC4HDAC2HDAC8GPR84GSTP1
SCHEMBL25624648 0.92 GPR84 (0.39) HDAC4HDAC2HDAC8GPR84GSTP1
SCHEMBL17320839 0.92 PLA2G2A (0.41) HDAC4HDAC2HDAC8GPR84ALOX5
SCHEMBL22545091 0.92 HDAC4 (0.38) HDAC4HDAC2HDAC8GPR84GSTP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210320251-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPLIANCE IDEMITSU KOSAN CO.,LTD. (JP) 2021-10-14 — — US disclosed
US-20200212315-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, ELECTRONIC DEVICE, AND COMPOUND IDEMITSU KOSAN CO.,LTD. (JP) 2020-07-02 — — US disclosed
US-20200185620-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2020-06-11 — — US disclosed
US-20200181160-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2020-06-11 — — 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 (4 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-20210320251-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPLIANCE OLA1, TAS2R19, TMEM109 HDAC4 2047/4885HDAC2 145/4885HDAC8 1085/4885
US-20200212315-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, ELECTRONIC DEVICE, AND COMPOUND OR10J3, ESR1, NFE2L2 HDAC4 3210/4885HDAC2 724/4885HDAC8 4084/4885
US-20200181160-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE AHR, EMC2, NFE2L2 HDAC4 2115/4885HDAC2 513/4885HDAC8 2348/4885
US-20200185620-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE EMC2, NFE2L2, AOC2 HDAC4 2054/4885HDAC2 460/4885HDAC8 2531/4885

“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.

Send feedback