SCHEMBL6860355

SCHEMBL6860355

CCC1(CC)C2CC3CC(C2)CC1(C(=O)Br)C3

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 2/20 0.33
HSD11B1 P28845 2/20 0.33
EPHX2 P34913 1/20 0.33
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL6859528 0.84 KMT2A (0.35) KMT2ASMN1; SMN2ALDH1A1MEN1HSD11B1
SCHEMBL6854139 0.84 KMT2A (0.35) KMT2ASMN1; SMN2ALDH1A1MEN1HSD11B1
SCHEMBL6854374 0.77 EPHX1 (0.34) ALDH1A1HSD11B1EPHX2HSD17B10
SCHEMBL6859448 0.73 EPHX2 (0.39) KMT2AALDH1A1MEN1EPHX2HSD17B10
SCHEMBL6860310 0.71 HSD11B1 (0.34) KMT2ASMN1; SMN2HSD11B1
SCHEMBL6861145 0.69 PKM (0.31) ALDH1A1
SCHEMBL1940081 0.69 GRIN2D (0.32) KMT2ASMN1; SMN2HSD11B1
SCHEMBL31084411 0.68 HSD11B1 (0.36) KMT2ASMN1; SMN2ALDH1A1MEN1HSD11B1
SCHEMBL10774980 0.67 GRIN2D (0.31) HSD11B1
SCHEMBL3476230 0.67 ALDH1A1 (0.37) KMT2ASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6794528-B2 HEAT RESISTANCE, FLAME RETARDERS, STABILIZERS; REACTING DIALCOHOL COMPOUND WITH A PHOSPHYL OXYCHLORIDE COMPOUND DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2004-09-21 US disclosed
US-20030109736-A1 Phosphorus compound DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2003-06-12 US disclosed
EP-1277758-A1 PHOSPHORUS COMPOUND Daicel Chemical Industries, Ltd. (JP) 2003-01-22 EP 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-20030109736-A1 Phosphorus compound NR4A1, POLL, NR0B1 KMT2A 1756/4885SMN1; SMN2 3216/4885ALDH1A1 3180/4885

“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.