SCHEMBL5863553

SCHEMBL5863553

O=C(NCCc1ccc(O)cc1)c1ccc(N2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.57
▸ MEN1 O00255 2/20 0.57
▸ KMT2A Q03164 2/20 0.57
▸ SCD O00767 1/20 0.55
▸ DRD2 P14416 3/20 0.55
▸ DRD3 P35462 3/20 0.55
▸ ADRA1A P35348 1/20 0.55
▸ ESRRG P62508 2/20 0.52
▸ ESRRB O95718 1/20 0.52
▸ ME2 P23368 1/20 0.50
▸ ME1 P48163 1/20 0.50
▸ ME3 Q16798 1/20 0.50
▸ NAMPT P43490 1/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ POLB P06746 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ EGFR P00533 1/20 0.49

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
SCHEMBL5863404 0.88 LMNA (0.74) LMNAMEN1KMT2ASCDDRD2
SCHEMBL15607119 0.79 CYP2D6 (0.60) MEN1KMT2AESRRGESRRBNAMPT
SCHEMBL30883140 0.75 SERPINE1 (0.61) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL11889675 0.74 SMN1; SMN2 (0.68) LMNAMEN1KMT2ASCDESRRG
SCHEMBL10900911 0.73 SIGMAR1 (0.76) DRD2DRD3ALDH1A1KDM4EMAPT
SCHEMBL31420450 0.73 NPC1 (0.84) ESRRGESRRBNAMPTKDM4EMAPT
SCHEMBL24076498 0.73 DRD2 (0.66) DRD2DRD3ADRA1AMAPTPOLB
SCHEMBL30301412 0.73 DRD2 (0.66) DRD2DRD3ADRA1AMAPTPOLB
SCHEMBL7056313 0.72 DRD3 (0.73) DRD2DRD3ADRA1A
SCHEMBL7056355 0.72 DRD2 (0.73) DRD2DRD3ADRA1A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7125997-B2 Differential tumor cytotoxicity compounds and compositions IRM LLC (BM) 2006-10-24 — — US claimed
US-7125997-B2 Differential tumor cytotoxicity compounds and compositions IRM LLC (BM) 2006-10-24 — — US disclosed
US-20040132786-A1 Differential tumor cytotoxicity compounds and compositions IRM LLC, A DELAWARE LIMITED LIABILITY COMPANY (BM) 2004-07-08 — — 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-20040132786-A1 Differential tumor cytotoxicity compounds and compositions MIF, FOXM1, MYADM LMNA 2253/4885MEN1 1175/4885KMT2A 4187/4885

“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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