SCHEMBL6804015

SCHEMBL6804015

Cc1ccc(C(=O)Nc2ccc3c(c2)NCCN3CCc2ccccn2)c(-c2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMO Q99835 2/20 0.47
MTTP P55157 6/20 0.43
APOB P04114 3/20 0.43
TRPV4 Q9HBA0 4/20 0.40
KDM4E B2RXH2 2/20 0.40
NR3C1 P04150 2/20 0.40
SLC11A2 P49281 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
SRPK1 Q96SB4 1/20 0.37

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
SCHEMBL6804937 0.92 SMO (0.56) SMOMTTPAPOBKDM4EALDH1A1
SCHEMBL6798306 0.88 SMO (0.47) SMOMTTPAPOBTRPV4KDM4E
SCHEMBL6635669 0.85 HTR2A (0.45) SMO
SCHEMBL6802807 0.80 SMO (0.54) SMOMTTPAPOBKDM4EALDH1A1
SCHEMBL6488178 0.80 SMO (0.52) SMOMTTPAPOBNR3C1
SCHEMBL6799860 0.80 SMO (0.61) SMOMTTPAPOBKDM4EALDH1A1
SCHEMBL6805661 0.79 SMO (0.55) SMOMTTPAPOBTRPV4KDM4E
SCHEMBL6809534 0.79 SMO (0.48) SMOMTTPAPOBKDM4ENR3C1
SCHEMBL6801109 0.79 SMO (0.47) SMOMTTPAPOBTRPV4NR3C1
SCHEMBL6803431 0.78 SMO (0.60) SMOMTTPAPOBKDM4EALDH1A1

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.