SCHEMBL22772263

SCHEMBL22772263

[2H]c1c(-c2ccc(N3CCCCC3)cc2)oc2c(OC)c(OC)ccc2c1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP8 P40818 7/20 0.51
▸ CYP1A2 P05177 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ NCOA1 Q15788 1/20 0.49
▸ NCOA3 Q9Y6Q9 1/20 0.49
▸ TERT O14746 4/20 0.47
▸ ACHE P22303 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ CYP1A1 P04798 3/20 0.41
▸ CYP1B1 Q16678 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ PABPC1 P11940 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ TUBB4A P04350 1/20 0.40
▸ TUBB P07437 1/20 0.40
▸ TUBA3C P0DPH7 1/20 0.40
▸ TUBA1B P68363 1/20 0.40

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
SCHEMBL21647149 0.89 CYP3A4 (0.63) USP8CYP1A2CYP3A4CYP2C19NCOA1
SCHEMBL22772267 0.88 ALDH1A1 (0.52) USP8CYP1A2CYP3A4CYP2C19TERT
SCHEMBL22772270 0.78 TERT (0.50) USP8CYP3A4CYP2C19TERTKDM4E
SCHEMBL21647176 0.77 USP8 (0.72) USP8CYP1A2CYP3A4CYP2C19NCOA1
SCHEMBL21647174 0.77 ALDH1A1 (0.47) USP8CYP1A2CYP3A4TERTACHE
SCHEMBL22789207 0.77 ACHE (0.43) USP8CYP1A2CYP3A4CYP2C19NCOA1
SCHEMBL21668602 0.77 ABCG2 (0.47) USP8CYP1A2CYP3A4TERTACHE
SCHEMBL23473437 0.76 USP8 (0.58) USP8CYP1A2CYP3A4CYP2C19NCOA1
SCHEMBL6612282 0.69 TUBB4A (0.76) CYP1A2CYP3A4CYP2C19NCOA1NCOA3
SCHEMBL21647169 0.69 CYP1A2 (0.73) CYP1A2CYP3A4CYP2C19NCOA1NCOA3

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
EP-3831821-A1 COMPOUND FOR TREATING NERVOUS SYSTEM DISEASES AND USE THEREOF Shaanxi Micot Technology Limited Company (CN) 2021-06-09 — — EP disclosed
US-20200390755-A1 COMPOUND FOR TREATING NERVOUS SYSTEM DISEASES AND USE THEREOF SHAANXI MICOT TECHNOLOGY CO., LTD. (CN) 2020-12-17 — — 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-20200390755-A1 COMPOUND FOR TREATING NERVOUS SYSTEM DISEASES AND USE THEREOF MAPT, PYGB, SLC6A2 USP8 3391/4885CYP1A2 68/4885CYP3A4 184/4885

“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.

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