SCHEMBL31350677

SCHEMBL31350677

NCc1cncc(C(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.60
▸ CA12 O43570 1/20 0.53
▸ CA1 P00915 1/20 0.53
▸ CA2 P00918 1/20 0.53
▸ CA7 P43166 1/20 0.53
▸ CA9 Q16790 1/20 0.53
▸ CA14 Q9ULX7 1/20 0.53
▸ KMT2A Q03164 4/20 0.51
▸ MEN1 O00255 3/20 0.51
▸ ALDH1A1 P00352 4/20 0.50
▸ USP2 O75604 2/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ NPSR1 Q6W5P4 4/20 0.49
▸ MAPT P10636 4/20 0.48
▸ POLB P06746 1/20 0.48

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
SCHEMBL31350758 0.89 MAOB (0.61) MAOBCA12CA1CA2CA7
SCHEMBL27405653 0.85 MAOB (0.66) MAOBCA12CA1CA2CA7
SCHEMBL27406350 0.84 MAOB (0.68) MAOBCA12CA1CA2CA7
SCHEMBL31351131 0.83 MAOB (0.66) MAOBCA12CA1CA2CA7
SCHEMBL27405651 0.82 SCN5A (0.43) MAOBCA12CA1CA2CA7
SCHEMBL16598663 0.82 MAOB (0.64) MAOBCA12CA1CA2CA7
SCHEMBL30961614 0.82 MAOB (0.64) MAOBCA12CA1CA2CA7
SCHEMBL31350838 0.82 MAOB (0.64) MAOBCA12CA1CA2CA7
SCHEMBL16598958 0.82 MAOB (0.64) MAOBCA12CA1CA2CA7
SCHEMBL16598964 0.82 MAOB (0.64) MAOBCA12CA1CA2CA7

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-20250084091-A1 INHIBITORS OF SARS-COV-2 TEXAS A & M UNIV SYS (US) 2025-03-13 — — 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-20250084091-A1 INHIBITORS OF SARS-COV-2 ACE2, ACE, TMPRSS2 MAOB 1253/4885CA12 2936/4885CA1 2390/4885

“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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