SCHEMBL8429787

SCHEMBL8429787

CCc1cc(Br)cc(Br)c1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.52
CA2 P00918 2/20 0.43
CA4 P22748 2/20 0.43
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
CA1 P00915 1/20 0.41
CA6 P23280 1/20 0.41
NCOA1 Q15788 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39
TACR1 P25103 1/20 0.39
TPMT P51580 1/20 0.38
PTGS2 P35354 1/20 0.38
ALDH1A1 P00352 1/20 0.37
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
KMT2A Q03164 1/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 1/20 0.37
APOBEC3A P31941 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL6736591 0.89 HSD17B10 (0.42) HSD17B10CA2CA4CA1CA6
SCHEMBL11222378 0.83 HSD17B10 (0.47) HSD17B10CA2CA4ALOX15ALOX12
SCHEMBL14154475 0.82 PTGS2 (0.50) CA2CA4ALOX15ALOX12CA1
SCHEMBL12514797 0.82 CA2 (0.42) HSD17B10CA2CA4CA1CA6
SCHEMBL6410058 0.82 HSD17B10 (0.50) HSD17B10CA2CA4ALOX15ALOX12
SCHEMBL3993269 0.80 ALDH1A1 (0.40) HSD17B10NCOA1NCOA3TPMTPTGS2
SCHEMBL14612683 0.80 CA2 (0.41) HSD17B10CA2CA4CA1CA6
SCHEMBL15715518 0.80 HTR2A (0.48) HSD17B10CA2CA4CA1CA6
SCHEMBL301662 0.79 HSD17B10 (0.59) HSD17B10CA2CA4ALOX15ALOX12
SCHEMBL17533811 0.79 HSD17B10 (0.43) HSD17B10CA2CA4ALOX15ALOX12

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-20040082578-A1 Arylindenopyridines and related therapeutic and prophylactic methods ORTHO-MCNEIL PHARMACEUTICAL, INC. 2004-04-29 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-20040082578-A1 Arylindenopyridines and related therapeutic and prophylactic methods ADORA2A, ADORA1, PDE2A HSD17B10 2928/4885CA2 1193/4885CA4 3334/4885

“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.