SCHEMBL6413095

SCHEMBL6413095

O=C(O)c1ccc(C2=CCCCCC2)s1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
POLB P06746 1/20 0.44
RAB9A P51151 1/20 0.44
ACMSD Q8TDX5 1/20 0.43
GLA P06280 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
RPS6KB2 Q9UBS0 1/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
GAA P10253 1/20 0.41
HPGDS O60760 1/20 0.40
MKNK1 Q9BUB5 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40
DAO P14920 3/20 0.38

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
Bicarbonate SCHEMBL10962051 0.72 ACMSD (0.49) ACMSDALDH1A1
Bicarbonate SCHEMBL2907611 0.72 ACMSD (0.49) ACMSDALDH1A1
Bicarbonate SCHEMBL10441915 0.72 ACMSD (0.49) ACMSDALDH1A1
SCHEMBL593023 0.72 MEN1 (0.65) KMT2AMEN1POLBRAB9ARPS6KB2
SCHEMBL29803676 0.72 L3MBTL1 (0.44) KMT2AMEN1POLBRAB9AGLA
SCHEMBL9734047 0.70 TYMP (0.37) KMT2AMEN1ACMSDALDH1A1
SCHEMBL2615881 0.70 MEN1 (0.63) KMT2AMEN1POLBRAB9ARPS6KB2
SCHEMBL2615879 0.70 MEN1 (0.63) KMT2AMEN1POLBRAB9ARPS6KB2
Hydrochloric Acid SCHEMBL9447525 0.70 MEN1 (0.63) KMT2AMEN1POLBRAB9ARPS6KB2
Hydrochloric Acid SCHEMBL9447603 0.68 MEN1 (0.61) KMT2AMEN1POLBRAB9ARPS6KB2

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-20050209284-A1 Tec kinase inhibitors BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-09-22 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-20050209284-A1 Tec kinase inhibitors TEC, ITK, TXK KMT2A 1803/4885MEN1 3793/4885POLB 3466/4885

“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.