SCHEMBL6803858

SCHEMBL6803858

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

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMO Q99835 2/20 0.52
HTR2A P28223 6/20 0.48
HTR2C P28335 6/20 0.48
HTR2B P41595 6/20 0.48
MTTP P55157 7/20 0.47
APOB P04114 6/20 0.47
EIF2AK3 Q9NZJ5 1/20 0.46
RIPK1 Q13546 1/20 0.43
MAPT P10636 2/20 0.43
NPC1 O15118 1/20 0.43
TP53 P04637 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
SCHEMBL6804505 0.94 SMO (0.52) SMOHTR2AHTR2CHTR2BMTTP
SCHEMBL6802672 0.93 EIF2AK3 (0.50) SMOHTR2AHTR2CHTR2BEIF2AK3
SCHEMBL6801953 0.92 SMO (0.52) SMOHTR2AHTR2CHTR2BMTTP
SCHEMBL6804573 0.92 SMO (0.51) SMOHTR2AHTR2CHTR2BMTTP
SCHEMBL6803779 0.92 EIF2AK3 (0.48) SMOHTR2AHTR2CHTR2BEIF2AK3
SCHEMBL6804688 0.92 SMO (0.61) SMOHTR2AHTR2CHTR2BMTTP
SCHEMBL6667059 0.92 EIF2AK3 (0.48) SMOHTR2AHTR2CHTR2BEIF2AK3
SCHEMBL6808934 0.91 SMO (0.52) SMOHTR2AHTR2CHTR2BMTTP
SCHEMBL6805251 0.91 SMO (0.50) SMOHTR2AHTR2CHTR2BMTTP
SCHEMBL6800481 0.90 EIF2AK3 (0.48) SMOHTR2AHTR2CHTR2BEIF2AK3

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 4390/4885HTR2A 2176/4885HTR2C 2433/4885

“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.