SCHEMBL23957165

SCHEMBL23957165

Cn1ccc2cc(CNC(=O)N3CCC4(CC3)CC(=O)c3ccc(F)cc3O4)cnc21

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 11/20 0.68
▸ HDAC8 Q9BY41 2/20 0.42
▸ HDAC6 Q9UBN7 2/20 0.42
▸ HSD11B1 P28845 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ GLA P06280 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ HDAC3 O15379 1/20 0.39
▸ HDAC4 P56524 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC7 Q8WUI4 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ HDAC10 Q969S8 1/20 0.39
▸ HDAC11 Q96DB2 1/20 0.39
▸ HDAC9 Q9UKV0 1/20 0.39
▸ HDAC5 Q9UQL6 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
SCHEMBL23957132 0.94 CHRNA7 (0.78) CHRNA7HDAC8HDAC6HDAC3HDAC4
SCHEMBL23957157 0.87 CHRNA7 (0.68) CHRNA7HDAC8HDAC6HSD11B1KDM4E
SCHEMBL23957138 0.87 CHRNA7 (0.86) CHRNA7
SCHEMBL23957174 0.84 CHRNA7 (0.64) CHRNA7
SCHEMBL23928880 0.81 CHRNA7 (1.00) CHRNA7
SCHEMBL23957092 0.80 CHRNA7 (0.75) CHRNA7HDAC8HDAC6HSD11B1KDM4E
SCHEMBL23957162 0.80 CHRNA7 (0.65) CHRNA7
SCHEMBL23957163 0.79 CHRNA7 (0.61) CHRNA7HDAC8HDAC6KDM4EALDH1A1
SCHEMBL23957121 0.78 CHRNA7 (0.65) CHRNA7HDAC8HDAC6HSD11B1
SCHEMBL23957099 0.77 CHRNA7 (0.69) CHRNA7HDAC8HDAC6HSD11B1KDM4E

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-20210330650-A1 SPIROCHROMANE DERIVATIVES RICHTER GEDEON NYRT. (HU) 2021-10-28 — — 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-20210330650-A1 SPIROCHROMANE DERIVATIVES CHRNA7, CHRM3, ADRB3 CHRNA7 1/4885HDAC8 222/4885HDAC6 537/4885

“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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