SCHEMBL3237202

SCHEMBL3237202

BrCc1ccc(OCc2ccccc2)c(Br)c1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
FOLH1 Q04609 1/20 0.48
PTPN1 P18031 1/20 0.47
CCR5 P51681 2/20 0.46
KDM4E B2RXH2 1/20 0.45
HPGD P15428 1/20 0.45
TLR9 Q9NR96 1/20 0.45
MAOB P27338 1/20 0.45
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
THRA P10827 1/20 0.44
THRB P10828 1/20 0.44
SLC6A4 P31645 1/20 0.43
TRPA1 O75762 1/20 0.43
ALDH1A1 P00352 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL1989845 0.86 SMN1; SMN2 (0.60) RAB9ASMN1; SMN2FOLH1PTPN1KDM4E
SCHEMBL12772163 0.86 RAB9A (0.56) RAB9ASMN1; SMN2FOLH1PTPN1KDM4E
SCHEMBL20482622 0.86 FFAR1 (0.47) RAB9ASMN1; SMN2FOLH1CCR5KDM4E
SCHEMBL1995693 0.86 RAB9A (0.56) RAB9ASMN1; SMN2FOLH1PTPN1CCR5
SCHEMBL3236287 0.86 SLC2A1 (0.52) RAB9AFOLH1KDM4EMAPTMAPK1
SCHEMBL4406802 0.85 RAB9A (0.55) RAB9ASMN1; SMN2FOLH1PTPN1CCR5
SCHEMBL3986458 0.85 RAB9A (0.55) RAB9ASMN1; SMN2FOLH1PTPN1CCR5
Benzyl Bromide SCHEMBL5761499 0.84 RAB9A (0.51) RAB9ASMN1; SMN2CCR5MAPTTDP1
SCHEMBL30812208 0.82 MAOB (0.54) SMN1; SMN2MAOBTSHR
SCHEMBL27381003 0.82 MAOB (0.54) SMN1; SMN2MAOBTSHR

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
US-7745472-B2 Compound STERIX LIMITED (GB) 2010-06-29 US disclosed
US-20090111862-A1 Compound RICHTER GEDEON NYRT. (HU) 2009-04-30 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-20090111862-A1 Compound QPCT, SQOR, SDHA RAB9A 2278/4885SMN1; SMN2 4170/4885FOLH1 193/4885

“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.