SCHEMBL6803201

SCHEMBL6803201

COCc1ccc(C(=O)Nc2ccc3c(c2)CCN3C(=O)Cc2ccccn2)c(-c2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.49
HTR2C P28335 5/20 0.49
HTR2B P41595 5/20 0.49
SMO Q99835 2/20 0.49
EIF2AK3 Q9NZJ5 1/20 0.43
MTTP P55157 7/20 0.43
APOB P04114 5/20 0.43
RIPK1 Q13546 2/20 0.41
TACR1 P25103 1/20 0.41

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
SCHEMBL6804211 0.93 HTR2A (0.48) HTR2AHTR2CHTR2BSMOEIF2AK3
SCHEMBL6808934 0.92 SMO (0.52) HTR2AHTR2CHTR2BSMOEIF2AK3
SCHEMBL6666430 0.90 SMO (0.49) HTR2AHTR2CHTR2BSMOEIF2AK3
SCHEMBL6803858 0.89 SMO (0.52) HTR2AHTR2CHTR2BSMOEIF2AK3
SCHEMBL6801953 0.89 SMO (0.52) HTR2AHTR2CHTR2BSMOEIF2AK3
SCHEMBL6804688 0.88 SMO (0.61) HTR2AHTR2CHTR2BSMOEIF2AK3
SCHEMBL6805026 0.88 HTR2C (0.51) HTR2AHTR2CHTR2BSMOEIF2AK3
SCHEMBL6805251 0.87 SMO (0.50) HTR2AHTR2CHTR2BSMOEIF2AK3
SCHEMBL6804573 0.87 SMO (0.51) HTR2AHTR2CHTR2BSMOEIF2AK3
SCHEMBL6804505 0.85 SMO (0.52) HTR2AHTR2CHTR2BSMOEIF2AK3

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 HTR2A 2176/4885HTR2C 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.