SCHEMBL14090236

SCHEMBL14090236

O=C(c1ccc2nc(-c3cc(-c4cccnc4Cl)ccc3O)[nH]c2c1)N1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ RIPK1 Q13546 1/20 0.47
▸ PIK3CD O00329 1/20 0.45
▸ PIK3CA P42336 1/20 0.45
▸ MTOR P42345 1/20 0.45
▸ HDAC6 Q9UBN7 2/20 0.44
▸ ATR Q13535 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ FGFR1 P11362 2/20 0.43
▸ FGFR2 P21802 2/20 0.43
▸ FGFR3 P22607 2/20 0.43
▸ KDR P35968 2/20 0.43
▸ FLT3 P36888 3/20 0.43
▸ ERN1 O75460 1/20 0.43
▸ HDAC3 O15379 1/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC2 Q92769 1/20 0.43
▸ HDAC8 Q9BY41 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
SCHEMBL14090386 0.91 RIPK1 (0.48) MEN1KMT2ARIPK1PIK3CDPIK3CA
SCHEMBL14090227 0.88 FGFR1 (0.49) MEN1KMT2ARIPK1PIK3CDPIK3CA
SCHEMBL14090235 0.87 HDAC6 (0.42) MEN1KMT2ARIPK1HDAC6ATR
SCHEMBL14090220 0.85 HDAC6 (0.51) MEN1KMT2APIK3CDPIK3CAMTOR
SCHEMBL14090252 0.85 ACACB (0.49) MEN1KMT2ARIPK1PIK3CDPIK3CA
SCHEMBL14090245 0.85 MEN1 (0.53) MEN1KMT2APIK3CDPIK3CAMTOR
SCHEMBL14090212 0.84 PIK3CD (0.49) MEN1KMT2APIK3CDPIK3CAMTOR
SCHEMBL14090263 0.82 HDAC6 (0.49) MEN1KMT2APIK3CDPIK3CAMTOR
SCHEMBL14090238 0.81 HDAC6 (0.51) MEN1KMT2AHDAC6ATRNPC1
SCHEMBL14091327 0.80 MEN1 (0.53) MEN1KMT2ARIPK1PIK3CDPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8629147-B2 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION (US) 2014-01-14 — — US disclosed
US-8629147-B2 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION (US) 2014-01-14 — — US disclosed
US-20080207635-A1 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION 2008-08-28 — — US disclosed
US-20080207635-A1 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION 2008-08-28 — — 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-20080207635-A1 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders LCK, MALT1, MYD88 MEN1 1879/4885KMT2A 1726/4885RIPK1 255/4885

“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.

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