SCHEMBL4913374

SCHEMBL4913374

O=C(NCC1C2CN(Cc3ccccc3)CC12)C1Cc2ccccc2CN1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.56
MEN1 O00255 2/20 0.56
POLB P06746 1/20 0.47
PRMT5 O14744 1/20 0.47
WDR77 Q9BQA1 1/20 0.47
BLM P54132 1/20 0.46
CXCR3 P49682 3/20 0.45
HDAC8 Q9BY41 2/20 0.43
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42
OPRK1 P41145 1/20 0.42

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
SCHEMBL4650285 0.83 KMT2A (0.43) KMT2AMEN1PRMT5WDR77BLM
SCHEMBL4650499 0.78 KMT2A (0.51) KMT2AMEN1POLBPRMT5WDR77
SCHEMBL4650250 0.77 CFTR (0.43) POLBOPRM1OPRD1OPRK1
SCHEMBL6240572 0.77 KMT2A (0.70) KMT2AMEN1POLBPRMT5WDR77
SCHEMBL4649495 0.77 PRMT5 (0.46) KMT2AMEN1POLBPRMT5WDR77
SCHEMBL1014404 0.77 S1PR5 (0.50) KMT2A
SCHEMBL4924735 0.77 TSHR (0.48) OPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL4786521 0.76 KMT2A (0.73) KMT2AMEN1POLBPRMT5WDR77
SCHEMBL13073431 0.76 KMT2A (0.85) KMT2AMEN1POLBPRMT5WDR77
SCHEMBL19972744 0.76 KMT2A (0.85) KMT2AMEN1POLBPRMT5WDR77

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-20080255188-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-10-16 US claimed
US-20080255188-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-10-16 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-20080255188-A1 Muscarinic Receptor Antagonists CHRM3, CHRM5, CHRM2 KMT2A 3036/4885MEN1 1581/4885POLB 3669/4885

“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.