SCHEMBL6499684

SCHEMBL6499684

COc1ccc(-c2ccc(C(F)(F)F)cc2)c(C(=O)Nc2ccc(OCCc3ccccn3)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMO Q99835 2/20 0.50
TRPV1 Q8NER1 2/20 0.48
RUVBL1 Q9Y265 1/20 0.44
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44
MTTP P55157 3/20 0.43
APOB P04114 2/20 0.43
P2RX1 P51575 1/20 0.43
TMPRSS4 Q9NRS4 1/20 0.43
NR3C1 P04150 2/20 0.43
NPC1 O15118 1/20 0.43
MAPT P10636 1/20 0.43
PKM P14618 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PPARG P37231 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
NCOR2 Q9Y618 1/20 0.43
CYP3A4 P08684 1/20 0.42
PLG P00747 1/20 0.42

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
SCHEMBL6491596 0.91 NPC1 (0.53) SMOTRPV1RUVBL1POLBGAA
SCHEMBL6503248 0.91 HTR2C (0.49) SMOTRPV1RUVBL1GAAMTTP
SCHEMBL7080705 0.89 SMO (0.49) SMOTRPV1POLBGAAMTTP
SCHEMBL6793327 0.89 SMO (0.59) SMOTRPV1POLBGAAMTTP
SCHEMBL6490835 0.86 SMO (0.50) SMOTRPV1MTTPAPOBNR3C1
SCHEMBL6487848 0.85 SMO (0.46) SMOTRPV1RUVBL1GAAMTTP
SCHEMBL6488795 0.84 SMO (0.50) SMOTRPV1MTTPAPOBNR3C1
SCHEMBL6499284 0.84 SMO (0.49) SMOTRPV1GAAMTTPAPOB
SCHEMBL6501945 0.83 NPC1 (0.56) POLBGAANPC1MAPTPKM
SCHEMBL6502809 0.83 L3MBTL1 (0.46) SMONPC1MAPTPKMRAB9A

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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors DAISO CO., LTD. (JP) 2005-02-17 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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors APOB, APOL1, CTRB2 SMO 2580/4885TRPV1 2245/4885RUVBL1 3734/4885

“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.