SCHEMBL23957121

SCHEMBL23957121

O=C1CC2(CCN(C(=O)NCc3ccc4[nH]ccc4c3)CC2)Oc2cc(F)ccc21

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 12/20 0.65
▸ METAP2 P50579 2/20 0.46
▸ KCNH2 Q12809 2/20 0.44
▸ EPHX1 P07099 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ EPHX2 P34913 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ HSD11B1 P28845 1/20 0.41
▸ PAX8 Q06710 1/20 0.41

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
SCHEMBL23957115 0.92 CHRNA7 (0.76) CHRNA7METAP2KCNH2EPHX1CYP2D6
SCHEMBL23957090 0.85 CHRNA7 (0.55) CHRNA7METAP2KCNH2EPHX1CYP2D6
SCHEMBL23957138 0.82 CHRNA7 (0.86) CHRNA7
SCHEMBL23957161 0.80 CHRNA7 (0.83) CHRNA7METAP2KCNH2HDAC8HDAC6
SCHEMBL23928886 0.79 CHRNA7 (0.79) CHRNA7METAP2KCNH2HDAC8HDAC6
SCHEMBL23928853 0.79 CHRNA7 (1.00) CHRNA7
SCHEMBL30094734 0.79 CHRNA7 (0.61) CHRNA7KCNH2HDAC8HDAC6HSD11B1
SCHEMBL23957140 0.78 TRPM8 (0.53) CHRNA7KCNH2EPHX1CYP2D6EPHX2
SCHEMBL23957165 0.78 CHRNA7 (0.68) CHRNA7HDAC8HDAC6HSD11B1
SCHEMBL23928859 0.78 CHRNA7 (0.79) CHRNA7HDAC8HDAC6HSD11B1

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 1/4885METAP2 3661/4885KCNH2 385/4885

“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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