SCHEMBL14091246

SCHEMBL14091246

CN1CCCc2cc(-c3nc4ccc(C(=O)N5CCOCC5)cc4[nH]3)ccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 5/20 0.50
▸ PIK3CD O00329 2/20 0.50
▸ PIK3CB P42338 1/20 0.50
▸ PIK3CA P42336 4/20 0.49
▸ SIRT2 Q8IXJ6 2/20 0.48
▸ SIRT1 Q96EB6 2/20 0.48
▸ FGFR1 P11362 3/20 0.47
▸ KDR P35968 3/20 0.47
▸ FGFR2 P21802 2/20 0.47
▸ FGFR3 P22607 2/20 0.47
▸ ATR Q13535 1/20 0.46
▸ HDAC3 O15379 2/20 0.46
▸ HDAC1 Q13547 2/20 0.46
▸ HDAC2 Q92769 2/20 0.46
▸ HDAC8 Q9BY41 2/20 0.46
▸ HDAC6 Q9UBN7 2/20 0.46
▸ CHEK2 O96017 1/20 0.46
▸ FLT3 P36888 2/20 0.44
▸ PDGFRB P09619 1/20 0.43
▸ MEN1 O00255 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
SCHEMBL12833987 0.83 MMP2 (0.53) SIRT2SIRT1HDAC3HDAC1HDAC2
SCHEMBL14091260 0.78 PIK3CD (0.52) MTORPIK3CDPIK3CBPIK3CASIRT2
SCHEMBL14115835 0.77 SIRT2 (0.55) MTORPIK3CDPIK3CBPIK3CASIRT2
SCHEMBL14091247 0.77 TERT (0.70) FGFR1KDRPDGFRBMEN1KMT2A
SCHEMBL14091250 0.76 SIRT2 (0.55) MTORPIK3CDPIK3CBPIK3CASIRT2
SCHEMBL12833993 0.75 MEN1 (0.66) MTORPIK3CDPIK3CBPIK3CAFGFR1
SCHEMBL17324777 0.74 HPGD (0.55) KMT2AHPGD
SCHEMBL14091372 0.74 HDAC6 (0.65) KDRHDAC3HDAC1HDAC2HDAC8
SCHEMBL12833727 0.74 MEN1 (0.47) MTORPIK3CDPIK3CBPIK3CASIRT2
SCHEMBL14091373 0.74 HDAC6 (0.55) HDAC3HDAC1HDAC2HDAC8HDAC6

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 5 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
WO-2007056155-A1 HETEROCYCLIC COMPOUNDS AS TYROSINE KINASE MODULATORS CHEMBRIDGE RESEARCH LABORATORIES, INC. (US) 2007-05-18 — — WO 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 MTOR 87/4885PIK3CD 170/4885PIK3CB 136/4885

“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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