SCHEMBL6489763

SCHEMBL6489763

O=C(Cc1ccccn1)NC1Cc2ccccc2C1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.57
GRM7 Q14831 1/20 0.55
MAPT P10636 1/20 0.54
MTNR1A P48039 3/20 0.48
MTNR1B P49286 3/20 0.48
GLS O94925 5/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA5A P35218 1/20 0.46
CA7 P43166 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
ROCK2 O75116 1/20 0.46
POLB P06746 1/20 0.46
CHRNA7 P36544 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL10573582 0.90 MTNR1A (0.63) SIGMAR1GRM7MAPTMTNR1AMTNR1B
SCHEMBL6488557 0.87 SIGMAR1 (0.52) SIGMAR1GRM7MAPTMTNR1AMTNR1B
SCHEMBL6499176 0.83 KMT2A (0.50) SIGMAR1
SCHEMBL10576167 0.82 SIGMAR1 (0.64) SIGMAR1GLSSMN1; SMN2
SCHEMBL29765515 0.81 SIGMAR1 (0.63) SIGMAR1GLS
SCHEMBL29765379 0.80 SIGMAR1 (0.70) SIGMAR1
SCHEMBL25198406 0.79 SIGMAR1 (0.62) SIGMAR1GLSCA1CA2CA5A
SCHEMBL14654975 0.79 SIGMAR1 (0.62) SIGMAR1MAPTGLSSMN1; SMN2
SCHEMBL34468370 0.77 SIGMAR1 (0.56) SIGMAR1GLSCA1CA2CA5A
SCHEMBL29765435 0.77 SIGMAR1 (0.59) SIGMAR1GLS

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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors DAISO CO., LTD. (JP) 2005-02-17 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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors APOB, APOL1, CTRB2 SIGMAR1 792/4885GRM7 4045/4885MAPT 4202/4885

“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.