SCHEMBL22772267

SCHEMBL22772267

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ USP8 P40818 7/20 0.50
▸ TERT O14746 3/20 0.50
▸ CCNT1 O60563 2/20 0.41
▸ CDK4 P11802 2/20 0.41
▸ CCNA2 P20248 2/20 0.41
▸ CCND1 P24385 2/20 0.41
▸ CDK2 P24941 2/20 0.41
▸ CDK7 P50613 2/20 0.41
▸ CDK9 P50750 2/20 0.41
▸ CCNH P51946 2/20 0.41
▸ MNAT1 P51948 2/20 0.41
▸ CDK6 Q00534 2/20 0.41
▸ ACHE P22303 1/20 0.41
▸ MCL1 Q07820 2/20 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
SCHEMBL22772263 0.88 USP8 (0.51) ALDH1A1CYP3A4CYP2C19USP8TERT
SCHEMBL22772270 0.86 TERT (0.50) ALDH1A1CYP3A4MAPTCYP2C9HPGD
SCHEMBL21668603 0.80 ABCG2 (0.49) ALDH1A1CYP3A4MAPTHPGDUSP8
SCHEMBL21647149 0.78 CYP3A4 (0.63) ALDH1A1CYP3A4MAPTCYP2C9HPGD
SCHEMBL22789455 0.77 MAOA (0.44) ALDH1A1CYP3A4MAPTCYP2C9HPGD
SCHEMBL21647176 0.74 USP8 (0.72) CYP3A4CYP2C19USP8TERTCCNT1
SCHEMBL21647173 0.74 TERT (0.66) ALDH1A1CYP3A4MAPTCYP2C9HPGD
SCHEMBL22772252 0.72 TERT (0.42) ALDH1A1CYP3A4MAPTCYP2C9HPGD
SCHEMBL21668602 0.72 ABCG2 (0.47) ALDH1A1CYP3A4MAPTHPGDUSP8
SCHEMBL22772266 0.70 TERT (0.62) ALDH1A1CYP3A4MAPTCYP2C9HPGD

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 ALDH1A1 787/4885CYP3A4 184/4885MAPT 1/4885

“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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