SCHEMBL3609215

SCHEMBL3609215

O=C(N[C@H]1CCNC1)c1cc2cc(Cl)ccc2[nH]1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 2/20 0.69
MLLT1 Q03111 1/20 0.53
F10 P00742 2/20 0.52
PYGL P06737 9/20 0.52
PYGM P11217 6/20 0.52
F7 P08709 1/20 0.51
F3 P13726 1/20 0.51
HRH4 Q9H3N8 3/20 0.51
HRH3 Q9Y5N1 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50

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
SCHEMBL3603066 1.00 SMYD3 (0.69) SMYD3MLLT1F10PYGLPYGM
SCHEMBL3603062 1.00 SMYD3 (0.69) SMYD3MLLT1F10PYGLPYGM
SCHEMBL30578672 0.93 SMYD3 (0.76) SMYD3MLLT1PYGLPYGMF7
SCHEMBL3603913 0.90 ALOX15 (0.56) SMYD3MLLT1F10PYGLPYGM
SCHEMBL3603019 0.90 ALOX15 (0.56) SMYD3MLLT1F10PYGLPYGM
SCHEMBL3603024 0.90 ALOX15 (0.56) SMYD3MLLT1F10PYGLPYGM
SCHEMBL3610530 0.85 MLLT1 (0.73) SMYD3MLLT1PYGLPYGMMEN1
SCHEMBL3605634 0.85 GHSR (0.55) SMYD3MLLT1PYGLPYGMRXFP1
SCHEMBL3610534 0.85 MLLT1 (0.73) SMYD3MLLT1PYGLPYGMMEN1
SCHEMBL3607418 0.85 MLLT1 (0.53) SMYD3MLLT1PYGLPYGMHRH4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100035862-A1 NOVEL AZA-CYCLIC INDOLE-2-CARBOXAMIDES AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2010-02-11 US claimed
US-20100035862-A1 NOVEL AZA-CYCLIC INDOLE-2-CARBOXAMIDES AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2010-02-11 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-20100035862-A1 NOVEL AZA-CYCLIC INDOLE-2-CARBOXAMIDES AND METHODS OF USE THEREOF IDO2, IDO1, INMT SMYD3 811/4885MLLT1 2603/4885F10 4776/4885

“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.