SCHEMBL7527042

SCHEMBL7527042

CCC1c2ncn(OC(=O)C(F)(F)F)c2CCN1C(=O)COc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.39
P2RX7 Q99572 4/20 0.38
MEN1 O00255 1/20 0.38
KCNA5 P22460 1/20 0.38
CPT1A P50416 4/20 0.36
CPT2 P23786 2/20 0.36
LMNA P02545 2/20 0.36
HPGD P15428 1/20 0.36
CPT1B Q92523 1/20 0.36
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL7532744 0.93 LMNA (0.37) KMT2AP2RX7MEN1KCNA5CPT1A
SCHEMBL7530828 0.86 MEN1 (0.39) KMT2AMEN1KCNA5CPT1ACPT2
SCHEMBL7532232 0.83 PDK1 (0.40) P2RX7LMNANPC1RAB9ASMN1; SMN2
SCHEMBL7530149 0.81 P2RX7 (0.38) P2RX7
SCHEMBL7525111 0.80 P2RX7 (0.36) KMT2AP2RX7MEN1
Trifluoroacetic Acid SCHEMBL7527035 0.76 AOC3 (0.50) KMT2AMEN1KCNA5CPT1ACPT2
SCHEMBL7528877 0.76 PDK1 (0.39) P2RX7LMNANPC1RAB9ASMN1; SMN2
SCHEMBL7525099 0.73 ESR1 (0.36) P2RX7
SCHEMBL7528200 0.73 P2RX7 (0.34) KMT2AP2RX7MEN1MAPTALDH1A1
SCHEMBL7529918 0.70 PTGDR2 (0.41)

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
US-20020198189-A1 Treatment or prophylaxis of Semicarbazide-sensitive amine oxidase (SSAO) mediated complications in mammals including humans BIOVITRUM AB (SE) 2002-12-26 US disclosed
WO-2002038153-A1 NEW USE OF 4, 5, 6, 7-TETRAHYDROIMIDAZO-[4,5-C]PYRIDINE DERIVATIVES BIOVITRUM AB (SE) 2002-05-16 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-20020198189-A1 Treatment or prophylaxis of Semicarbazide-sensitive amine oxidase (SSAO) mediated complications in mammals including humans AOC3, AOC2, AOC1 KMT2A 2710/4885P2RX7 2655/4885MEN1 875/4885

“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.