SCHEMBL4865737

SCHEMBL4865737

CC[C@@H]1C(=O)N(Cc2ccccc2)c2cc(F)ccc2N1C(=O)c1cccc(O)c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.56
MEN1 O00255 4/20 0.48
POLB P06746 1/20 0.48
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
HTT P42858 1/20 0.42
TRPA1 O75762 1/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.39
PARK7 Q99497 1/20 0.39
CYP2D6 P10635 2/20 0.38
MAPK1 P28482 1/20 0.38
TSHR P16473 1/20 0.38
GSK3B P49841 1/20 0.38
ADK P55263 1/20 0.38
MAPT P10636 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL4866457 0.91 KMT2A (0.57) KMT2AMEN1POLBCRHBPCRHR2
SCHEMBL4864150 0.88 KMT2A (0.57) KMT2AMEN1POLBCRHBPCRHR2
SCHEMBL4864215 0.84 KMT2A (0.40) KMT2AMEN1LMNAMAPT
SCHEMBL4871200 0.84 KMT2A (0.53) KMT2AMEN1POLBCRHBPCRHR2
SCHEMBL4867500 0.79 KMT2A (0.43) KMT2AMEN1POLBTRPA1PARK7
SCHEMBL4867992 0.75 KMT2A (0.43) KMT2AMEN1POLBPARK7TSHR
SCHEMBL4866414 0.75 KMT2A (0.43) KMT2AMEN1POLBPARK7TSHR
SCHEMBL4502884 0.74 MGLL (0.35) KMT2AMEN1POLBLMNAMAPT
SCHEMBL4498568 0.74 MGLL (0.35) KMT2AMEN1POLBLMNAMAPT
SCHEMBL4499655 0.74 MGLL (0.35) KMT2AMEN1POLBLMNAMAPT

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-7351709-B2 Estrogen receptor ligands WYETH (US) 2008-04-01 US claimed
US-20060019961-A1 Estrogen receptor ligands WYETH 2006-01-26 US claimed
US-7351709-B2 Estrogen receptor ligands WYETH (US) 2008-04-01 US disclosed
US-20060019961-A1 Estrogen receptor ligands WYETH 2006-01-26 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-20060019961-A1 Estrogen receptor ligands GPER1, ESR2, ESR1 KMT2A 2436/4885MEN1 4543/4885POLB 4581/4885

“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.