SCHEMBL6804007

SCHEMBL6804007

O=C(Nc1ccc2c(c1)CCN2C(=O)Cc1ccccn1)c1ccccc1-c1cccc(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMO Q99835 2/20 0.49
HTR2C P28335 2/20 0.48
HTR2B P41595 2/20 0.48
EIF2AK3 Q9NZJ5 2/20 0.48
EIF2AK2 P19525 1/20 0.41
EIF2AK1 Q9BQI3 1/20 0.41
MAPT P10636 2/20 0.41
AVPR2 P30518 4/20 0.41
CREBBP Q92793 1/20 0.41
HTR2A P28223 1/20 0.41
AVPR1A P37288 3/20 0.41
HSD17B3 P37058 1/20 0.41
NPY2R P49146 1/20 0.40
OXTR P30559 1/20 0.40

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
SCHEMBL6804640 0.92 SMO (0.50) SMOHTR2CHTR2BEIF2AK3MAPT
SCHEMBL6809248 0.90 SMO (0.56) SMOHTR2CHTR2BEIF2AK3AVPR2
SCHEMBL6805188 0.88 HTR2C (0.51) SMOHTR2CHTR2BEIF2AK3EIF2AK1
SCHEMBL6805171 0.88 SMO (0.52) SMOHTR2CHTR2BEIF2AK3EIF2AK2
SCHEMBL6664230 0.88 GAA (0.48) SMOHTR2CHTR2BEIF2AK3MAPT
SCHEMBL6668503 0.87 EIF2AK3 (0.51) SMOHTR2CHTR2BEIF2AK3MAPT
SCHEMBL6804049 0.87 SMO (0.50) SMOHTR2CHTR2BEIF2AK3MAPT
SCHEMBL6803784 0.87 EIF2AK3 (0.53) SMOHTR2CHTR2BEIF2AK3EIF2AK1
SCHEMBL6804470 0.87 SMO (0.50) SMOHTR2CHTR2BEIF2AK3EIF2AK1
SCHEMBL6800472 0.86 EIF2AK3 (0.49) SMOHTR2CHTR2BEIF2AK3MAPT

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-20040157866-A1 Amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-12 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-20040157866-A1 Amide compounds APOB, NR1H2, NR1H3 SMO 4390/4885HTR2C 2433/4885HTR2B 928/4885

“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.