SCHEMBL6796691

SCHEMBL6796691

Cc1ccc(C(=O)Nc2ccc3c(c2)OCC(=O)N3)c(-c2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.50
TRPV1 Q8NER1 6/20 0.49
CYP3A4 P08684 1/20 0.47
CYP19A1 P11511 1/20 0.47
CYP2C9 P11712 1/20 0.47
KMT2A Q03164 2/20 0.45
APOB P04114 2/20 0.45
MTTP P55157 2/20 0.45
GRIN2D O15399 1/20 0.44
GRIN3B O60391 1/20 0.44
GRIN1 Q05586 1/20 0.44
GRIN2A Q12879 1/20 0.44
GRIN2B Q13224 1/20 0.44
GRIN2C Q14957 1/20 0.44
GRIN3A Q8TCU5 1/20 0.44
KDM4E B2RXH2 1/20 0.44
RAF1 P04049 2/20 0.43
MMP8 P22894 1/20 0.42
MMP13 P45452 1/20 0.42
MEN1 O00255 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
SCHEMBL6804281 0.88 KIF11 (0.55) KIF11TRPV1CYP3A4CYP19A1CYP2C9
SCHEMBL6808886 0.84 TRPV1 (0.48) TRPV1CYP3A4APOBMTTPKDM4E
SCHEMBL6803896 0.77 APOB (0.51) APOBMTTPKDM4E
Hydrochloric Acid SCHEMBL6804654 0.77 APOB (0.51) APOBMTTPKDM4E
SCHEMBL6490383 0.75 PTGS1 (0.58) KIF11TRPV1CYP3A4CYP2C9APOB
SCHEMBL6500905 0.74 TRPV1 (0.50) TRPV1CYP3A4CYP2C9APOBMTTP
SCHEMBL24508865 0.74 CYP2C9 (0.52) TRPV1CYP3A4CYP19A1CYP2C9KMT2A
SCHEMBL31423391 0.73 CYP3A4 (0.56) KIF11TRPV1CYP3A4CYP19A1CYP2C9
SCHEMBL4596430 0.73 KIF11 (0.59) KIF11TRPV1
SCHEMBL6687830 0.73 P2RX1 (0.48) TRPV1CYP3A4CYP2C9APOBMTTP

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022123039-A1 ALDEHYDE DEHYDROGENASE INHIBITORS AND THEIR THERAPEUTIC USE CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2022-06-16 WO disclosed
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 KIF11 4663/4885TRPV1 2399/4885CYP3A4 1683/4885

“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.