SCHEMBL22789207

SCHEMBL22789207

Bc1c(-c2ccc(N3CCCCC3)cc2)oc2c(OC)c(OC)ccc2c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.43
▸ MAOA P21397 1/20 0.43
▸ USP8 P40818 1/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ TERT O14746 2/20 0.40
▸ NPC1 O15118 4/20 0.40
▸ RAB9A P51151 4/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ PABPC1 P11940 1/20 0.40
▸ ABCG2 Q9UNQ0 4/20 0.39
▸ ABCC1 P33527 3/20 0.39
▸ ABCB1 P08183 2/20 0.39
▸ S1PR1 P21453 1/20 0.39
▸ MAPT P10636 6/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ TSHR P16473 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39

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
SCHEMBL22789455 0.88 MAOA (0.44) ACHEMAOAUSP8ALDH1A1TERT
SCHEMBL21647174 0.88 ALDH1A1 (0.47) ACHEMAOAUSP8KDM4EALDH1A1
SCHEMBL21668602 0.87 ABCG2 (0.47) ACHEMAOAUSP8KDM4EALDH1A1
SCHEMBL21647149 0.78 CYP3A4 (0.63) USP8ALDH1A1TERTMAPTCYP3A4
SCHEMBL21668603 0.78 ABCG2 (0.49) ACHEMAOAUSP8KDM4EALDH1A1
SCHEMBL22789251 0.78 TERT (0.44) USP8KDM4ETERTMAPTPOLB
SCHEMBL22772263 0.77 USP8 (0.51) ACHEUSP8KDM4EALDH1A1TERT
SCHEMBL21647185 0.76 USP8 (0.50) ACHEMAOAUSP8TERT
SCHEMBL27381294 0.69 MAOA (0.56) MAOAKDM4EALDH1A1TERTABCG2
SCHEMBL21668590 0.67 CDK2 (0.54) KDM4EALDH1A1TERTABCG2MAPT

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-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 ACHE 9/4885MAOA 75/4885USP8 3391/4885

“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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