SCHEMBL1773236

SCHEMBL1773236

Brc1ccc(CC2OCCCO2)cc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
SMN1; SMN2 Q16637 6/20 0.36
ALDH1A1 P00352 4/20 0.36
LMNA P02545 3/20 0.36
HPGD P15428 2/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
HTT P42858 1/20 0.36
RECQL P46063 1/20 0.36
TAAR1 Q96RJ0 2/20 0.35
MAPT P10636 2/20 0.34
HTR2A P28223 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL7393096 0.92 HTR2A (0.37) MEN1KMT2ASMN1; SMN2HPGDNPC1
SCHEMBL25585 0.79 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1HPGDNPC1RAB9A
SCHEMBL2882191 0.78 CA2 (0.43) SMN1; SMN2ALDH1A1HPGDNPC1RAB9A
SCHEMBL5732606 0.78 MEN1 (0.44) MEN1KMT2ASMN1; SMN2ALDH1A1LMNA
SCHEMBL31545933 0.77 MDM2 (0.36) SMN1; SMN2NPC1RAB9AMAPTPOLB
Methyl Alcohol SCHEMBL28286625 0.76 ALDH1A1 (0.39) SMN1; SMN2ALDH1A1HPGDRAB9APOLB
SCHEMBL12419367 0.76 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL15371049 0.76 ALDH1A1 (0.42) MEN1KMT2ASMN1; SMN2ALDH1A1LMNA
SCHEMBL448797 0.75 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1HPGDRAB9APOLB
SCHEMBL3950950 0.73 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1HPGDRAB9APOLB

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
CN-102066337-A 5-hydroxypyrimidine-4-carboxamide compounds DAIICHI SANKYO CO LTD 2011-05-18 CN disclosed
US-20110112103-A1 5-HYDROXYPYRIMIDINE-4-CARBOXAMIDE COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-05-12 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-20110112103-A1 5-HYDROXYPYRIMIDINE-4-CARBOXAMIDE COMPOUND EPOR, CBR1, CBR3 MEN1 2513/4885KMT2A 415/4885SMN1; SMN2 2425/4885

“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.