SCHEMBL5175644

SCHEMBL5175644

COC(=O)Cc1ccc(OCCN2CCC(O)(c3ccccc3)CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.58
▸ ALDH1A1 P00352 1/20 0.58
▸ LMNA P02545 1/20 0.58
▸ KMT2A Q03164 1/20 0.58
▸ KDM1A O60341 1/20 0.57
▸ LTA4H P09960 8/20 0.52
▸ MMP1 P03956 2/20 0.50
▸ MMP9 P14780 2/20 0.50
▸ MMP13 P45452 2/20 0.50
▸ ADAM17 P78536 2/20 0.50
▸ SIGMAR1 Q99720 1/20 0.47
▸ DRD3 P35462 1/20 0.47
▸ DRD2 P14416 1/20 0.46

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
SCHEMBL5174031 0.89 MEN1 (0.57) MEN1ALDH1A1LMNAKMT2AKDM1A
SCHEMBL5175416 0.82 LTA4H (0.50) MEN1ALDH1A1LMNAKMT2AKDM1A
SCHEMBL25940273 0.81 LTA4H (0.62) KDM1ALTA4H
SCHEMBL6750008 0.81 OPRL1 (0.64) SIGMAR1
SCHEMBL12315758 0.80 KDM4E (0.63) KDM1ALTA4H
SCHEMBL4688810 0.80 MEN1 (0.62) MEN1ALDH1A1LMNAKMT2ALTA4H
SCHEMBL5175157 0.79 MEN1 (0.56) MEN1ALDH1A1LMNAKMT2ALTA4H
Hydrochloric Acid SCHEMBL7406712 0.79 MEN1 (0.61) MEN1ALDH1A1LMNAKMT2ALTA4H
SCHEMBL5175324 0.78 KCNA5 (0.54) MEN1ALDH1A1LMNAKMT2ALTA4H
SCHEMBL25377857 0.78 KDM1A (0.56) KDM1ALTA4HDRD3DRD2

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
EP-1868605-A2 PHENYL AND PYRIDYL LTA4H MODULATORS Janssen Pharmaceutica, N.V. (BE) 2007-12-26 — — EP disclosed
WO-2006105304-A2 PHENYL AND PYRIDYL LTA4H MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-10-05 — — WO disclosed
US-20060223792-A1 Phenyl and pyridyl LTA4H modulators JANSSEN PHARMACEUTICA N.V. (BE) 2006-10-05 — — 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-20060223792-A1 Phenyl and pyridyl LTA4H modulators LTA4H, LTB4R, LTC4S MEN1 4858/4885ALDH1A1 1142/4885LMNA 2091/4885

“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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