SCHEMBL6816210

SCHEMBL6816210

FC(F)(Br)c1cccc2c(C(Cl)(Cl)Br)cccc12

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HSD17B10 Q99714 1/20 0.35
KIF11 P52732 1/20 0.33
P2RX7 Q99572 1/20 0.32
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
HPGD P15428 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
PARP1 P09874 1/20 0.30

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
SCHEMBL6823414 0.88 CYP1A2 (0.36) KDM4ESMN1; SMN2HSD17B10KIF11ALDH1A1
SCHEMBL6819881 0.88 KIF11 (0.39) KDM4ESMN1; SMN2HSD17B10KIF11P2RX7
SCHEMBL6819380 0.78 P2RX7 (0.39) KDM4ESMN1; SMN2HSD17B10P2RX7ALDH1A1
SCHEMBL6816117 0.75 P2RX7 (0.36) KDM4ESMN1; SMN2HSD17B10P2RX7ALDH1A1
SCHEMBL6822912 0.75 P2RX7 (0.40) KDM4ESMN1; SMN2HSD17B10KIF11P2RX7
SCHEMBL6819899 0.75 P2RX7 (0.36) P2RX7ALDH1A1
SCHEMBL7613484 0.74 ALDH1A1 (0.43) KDM4EHSD17B10KIF11MEN1ALDH1A1
SCHEMBL6819263 0.72 P2RX7 (0.37) KDM4ESMN1; SMN2HSD17B10KIF11P2RX7
SCHEMBL6816727 0.72 P2RX7 (0.33) P2RX7ALDH1A1
SCHEMBL6820372 0.71 PIM1 (0.41) KDM4ESMN1; SMN2HSD17B10MEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0995734-B1 Method for production of halogen-containing aromatic compound NIPPON CATALYTIC CHEM IND (JP) 2004-05-12 EP disclosed
US-6433231-B2 BROMINATION THE CORRESPONDING NAPHTHALENE HALOGEN COMPOUND NIPPON SHOKUBAI CO., LTD. (JP) 2002-08-13 US disclosed
US-20010045350-A1 Method for production of halogen-containing aromatic compound NIPPON SHOKUBAI CO., LTD., A JAPAN CORPORATION 2001-11-29 US disclosed
US-6288290-B1 BROMINATION AND PHOTOBROMINATION OF AROMATIC COMPOUNDS NIPPON SHOKUBAI, CO., LTD. (JP) 2001-09-11 US disclosed
EP-0995734-A1 Method for production of halogen-containing aromatic compound Nippon Shokubai Co., Ltd. (JP) 2000-04-26 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-20010045350-A1 Method for production of halogen-containing aromatic compound CBR1, CBR3, DCXR KDM4E 2637/4885SMN1; SMN2 4164/4885HSD17B10 2453/4885

“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.