SCHEMBL6804505

SCHEMBL6804505

Cc1ccc(-c2ccc(C(F)(F)F)cc2)c(C(=O)Nc2ccc3c(c2)CCN3C(=O)Cc2ccccn2)c1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMO Q99835 2/20 0.52
MTTP P55157 8/20 0.49
APOB P04114 7/20 0.49
HTR2A P28223 6/20 0.48
HTR2C P28335 6/20 0.48
HTR2B P41595 6/20 0.48
EIF2AK3 Q9NZJ5 1/20 0.46
RIPK1 Q13546 1/20 0.43
NPC1 O15118 1/20 0.43
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL6803858 0.94 SMO (0.52) SMOMTTPAPOBHTR2AHTR2C
SCHEMBL6667964 0.93 EIF2AK3 (0.50) SMOHTR2AHTR2CHTR2BEIF2AK3
SCHEMBL6804573 0.92 SMO (0.51) SMOMTTPAPOBHTR2AHTR2C
SCHEMBL6803919 0.92 EIF2AK3 (0.48) SMOHTR2AHTR2CHTR2BEIF2AK3
SCHEMBL6804688 0.92 SMO (0.61) SMOMTTPAPOBHTR2AHTR2C
SCHEMBL6664878 0.92 EIF2AK3 (0.48) SMOHTR2AHTR2CHTR2BEIF2AK3
SCHEMBL6664848 0.91 HTR2A (0.53) SMOMTTPAPOBHTR2AHTR2C
SCHEMBL6804773 0.90 EIF2AK3 (0.48) SMOHTR2AHTR2CHTR2BEIF2AK3
SCHEMBL6801681 0.89 EIF2AK3 (0.47) SMOHTR2AHTR2CHTR2BEIF2AK3
SCHEMBL6805026 0.88 HTR2C (0.51) SMOMTTPAPOBHTR2AHTR2C

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 4390/4885MTTP 108/4885APOB 1/4885

“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.