SCHEMBL6488795

SCHEMBL6488795

CC(C)Oc1ccc(-c2ccc(C(F)(F)F)cc2)c(C(=O)Nc2ccc(NCCc3ccccn3)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMO Q99835 2/20 0.50
TRPV1 Q8NER1 4/20 0.48
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
MTTP P55157 2/20 0.43
APOB P04114 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAOB P27338 1/20 0.43
NR3C1 P04150 2/20 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
SCHEMBL6491596 0.93 NPC1 (0.53) SMOTRPV1NPC1RAB9AMTTP
SCHEMBL6499284 0.92 SMO (0.49) SMOTRPV1NPC1RAB9AMTTP
SCHEMBL6503346 0.90 HTT (0.49) NPC1RAB9ASMN1; SMN2MAOB
SCHEMBL6490703 0.90 NPC1 (0.48) NPC1RAB9ASMN1; SMN2MAOB
SCHEMBL6489909 0.90 TAS1R3 (0.51) SMOTRPV1NPC1MTTPAPOB
SCHEMBL6499260 0.90 CNR1 (0.50) NPC1RAB9ASMN1; SMN2MAOB
SCHEMBL6497909 0.89 SMO (0.52) SMOTRPV1MTTPAPOBSMN1; SMN2
SCHEMBL6492656 0.88 SMO (0.53) SMOTRPV1SMN1; SMN2NR3C1
SCHEMBL6491719 0.88 SMO (0.53) SMOTRPV1MTTPAPOBNR3C1
SCHEMBL6498051 0.87 SMO (0.49) SMOTRPV1NPC1RAB9AMTTP

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 2245/4885NPC1 100/4885

“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.