SCHEMBL22668790

SCHEMBL22668790

O=C(Nc1nnc(-c2ccc(F)cc2)o1)N1CCC2(CCC2)CC1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ADCY1 Q08828 11/20 0.54
▸ ADCY8 P40145 2/20 0.49
▸ POLB P06746 2/20 0.48
▸ LMNA P02545 2/20 0.47
▸ HTT P42858 1/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ HDAC2 Q92769 1/20 0.47
▸ OPRK1 P41145 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ CCR6 P51684 1/20 0.47

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
SCHEMBL22668807 0.98 ADCY1 (0.54) ADCY1ADCY8POLBLMNAHTT
SCHEMBL22668765 0.90 HDAC2 (0.59) ADCY1ADCY8POLBLMNAHTT
SCHEMBL22668800 0.88 ADCY1 (0.56) ADCY1ADCY8POLBLMNAHTT
SCHEMBL22668490 0.88 ADCY1 (0.61) ADCY1ADCY8POLBLMNAHTT
SCHEMBL22668794 0.87 ADCY1 (0.55) ADCY1ADCY8POLBLMNAHTT
SCHEMBL22668781 0.87 ADCY1 (0.60) ADCY1ADCY8POLBLMNAHTT
SCHEMBL22668461 0.87 ADCY1 (0.60) ADCY1ADCY8POLBLMNAHTT
SCHEMBL22668784 0.87 ADCY1 (0.52) ADCY1ADCY8POLBLMNAHTT
SCHEMBL22668589 0.86 ADCY1 (0.51) ADCY1ADCY8POLBLMNAHTT
SCHEMBL22668778 0.84 ADCY1 (0.54) ADCY1ADCY8POLBLMNAHTT

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-20200361882-A1 METABOLICALLY STABLE N-ACYLAMINOOXADIAZOLES USEFUL AS ANTIBACTERIAL AGENTS MICROBIOTIX, INC. (US) 2020-11-19 — — 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-20200361882-A1 METABOLICALLY STABLE N-ACYLAMINOOXADIAZOLES USEFUL AS ANTIBACTERIAL AGENTS RIOX2, MRPS35, AADAC ADCY1 3421/4885ADCY8 3428/4885POLB 611/4885

“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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