SCHEMBL6645504

SCHEMBL6645504

CN(C)c1cc(C(F)(F)F)ccc1C(=O)Nc1cnn(CCN(C(=O)O)c2ccccc2)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 9/20 0.42
CYP2C8 P10632 2/20 0.42
CYP2B6 P20813 2/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
HIF1A Q16665 5/20 0.41
SCD O00767 1/20 0.41
SCD5 Q86SK9 1/20 0.41
ALDH1A1 P00352 2/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL6650001 0.90 TRPV4 (0.45) TRPV4HIF1ASCDSCD5
SCHEMBL7201171 0.88 SCD (0.43) SCDSCD5ALDH1A1KMT2ATDP1
SCHEMBL6645501 0.84 LMNA (0.47) TRPV4HIF1AMAPT
SCHEMBL6642965 0.79 SCD (0.41) TRPV4SCDSCD5ALDH1A1MAPT
SCHEMBL6644600 0.78 SCD (0.42) TRPV4SCDSCD5ALDH1A1KMT2A
SCHEMBL6649993 0.76 LMNA (0.43) TRPV4HIF1AMAPT
SCHEMBL6648250 0.75 L3MBTL1 (0.43) ALDH1A1KMT2ATDP1MAPTRAB9A
SCHEMBL6643832 0.73 NAMPT (0.42) HIF1AALDH1A1KMT2AMAPTRAB9A
SCHEMBL6687617 0.72 LMNA (0.51) HIF1AMAPT
SCHEMBL6644189 0.72 AURKA (0.41) SCDSCD5ALDH1A1MAPTRAB9A

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-20040133008-A1 Amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-07-08 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-20040133008-A1 Amide compounds APOB, APOL1, LDLR TRPV4 3973/4885CYP2C8 1959/4885CYP2B6 1039/4885

“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.