SCHEMBL14075263

SCHEMBL14075263

CCC(=O)NCc1ccc(CNC)nc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.41
FAAH O00519 1/20 0.41
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
RAB9A P51151 1/20 0.37
HPGD P15428 2/20 0.37
ALDH1A1 P00352 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ATM Q13315 1/20 0.37
TPSAB1 Q15661 1/20 0.37
SRC P12931 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
GRIA2 P42262 1/20 0.36
MAPT P10636 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL13024401 0.80 TPSAB1 (0.50) CA1CA2LMNAHPGDALDH1A1
SCHEMBL14075257 0.80 NAMPT (0.49) POLBFAAHHPGDALDH1A1ATM
SCHEMBL5010821 0.79 AOC3 (0.44) POLBFAAHKDM4ELMNARAB9A
SCHEMBL5012151 0.78 FAAH (0.61) POLBFAAHKDM4ERAB9AHPGD
SCHEMBL24822410 0.78 KMT2A (0.54) CA1CA2KDM4EHPGDALDH1A1
Hydrochloric Acid SCHEMBL5013384 0.78 AOC3 (0.43) POLBFAAHKDM4ELMNARAB9A
SCHEMBL27114456 0.77 PIK3CD (0.39) POLBCA1CA2CYP2C9
SCHEMBL19580586 0.77 HRH3 (0.47) POLBKDM4ELMNARAB9AALDH1A1
SCHEMBL13024397 0.76 MAPT (0.46) KDM4ELMNARAB9AALDH1A1MEN1
SCHEMBL6935249 0.76 GABRP (0.53) POLBCA2KDM4ELMNAHPGD

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-20080221082-A1 Ligands of Integrin Receptors ABBOTT GMBH & CO. KG (DE) 2008-09-11 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-20080221082-A1 Ligands of Integrin Receptors ITGB3, ITGAV, ITGA2B POLB 4398/4885FAAH 4800/4885CA1 4283/4885

“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.