SCHEMBL16769478

SCHEMBL16769478

CC(=O)c1cc(C)c(I)c(C)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA5A P35218 1/20 0.48
▸ LMNA P02545 2/20 0.40
▸ CYP2A6 P11509 1/20 0.38
▸ HSD17B1 P14061 1/20 0.37
▸ TPMT P51580 1/20 0.36
▸ MAPT P10636 3/20 0.34
▸ RAB9A P51151 3/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.34
▸ HPGD P15428 2/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ NPC1 O15118 2/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ STAT3 P40763 1/20 0.34
▸ STAT1 P42224 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ FFAR4 Q5NUL3 1/20 0.34
▸ MAOB P27338 1/20 0.34
▸ CES2 O00748 1/20 0.33

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
SCHEMBL13652501 0.82 CA5A (0.38) CA5ALMNACYP2A6
SCHEMBL16384671 0.80 TPMT (0.58) CA5ALMNATPMTMAPTSMN1; SMN2
SCHEMBL18629882 0.79 CA5A (0.48) CA5ALMNAHSD17B1TPMTMAPT
SCHEMBL96185 0.79 CA5A (0.52) CA5ALMNACYP2A6HSD17B1MAPT
SCHEMBL16384672 0.78 TPMT (0.34) TPMTMAPTSMN1; SMN2KMT2ATDP1
SCHEMBL2869068 0.78 PARP1 (0.43) LMNAMAPTSMN1; SMN2L3MBTL1TDP1
SCHEMBL6377610 0.77 CA5A (0.50) CA5ALMNACYP2A6HSD17B1MAPT
SCHEMBL14264012 0.77 TPMT (0.61) CA5ALMNACYP2A6HSD17B1TPMT
SCHEMBL1644952 0.77 CA5A (0.56) CA5ALMNAHSD17B1MAPTRAB9A
SCHEMBL14264014 0.75 RAB9A (0.39) LMNATPMTMAPTRAB9ASMN1; SMN2

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-20150152047-A1 BENZAMIDE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-06-04 — — 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-20150152047-A1 BENZAMIDE DERIVATIVE CYP3A5, HDAC6, BRD1 CA5A 456/4885LMNA 3150/4885CYP2A6 215/4885

“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.

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