SCHEMBL14023911

SCHEMBL14023911

CO[C@H](c1ccc(N2CCOCC2)cc1)[C@H](N)CF

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.41
▸ MAPT P10636 6/20 0.41
▸ L3MBTL1 Q9Y468 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ ALOX15 P16050 2/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ GAA P10253 2/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ USP2 O75604 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ HIF1A Q16665 2/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ CYP17A1 P05093 1/20 0.38
▸ NPC1 O15118 2/20 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
SCHEMBL19062581 1.00 ALDH1A1 (0.41) ALDH1A1MAPTL3MBTL1KDM4EALOX15
SCHEMBL15628607 0.89 ALDH1A1 (0.38) ALDH1A1MAPTL3MBTL1KDM4EALOX15
SCHEMBL15628457 0.87 ALDH1A1 (0.40) ALDH1A1MAPTL3MBTL1KDM4EALOX15
SCHEMBL15628603 0.85 ADRB1 (0.48) ALDH1A1KDM4ELMNA
SCHEMBL15628460 0.85 LGMN (0.42) ALDH1A1MAPTL3MBTL1MAPK1SMN1; SMN2
SCHEMBL15628450 0.83 SMN1; SMN2 (0.52) ALDH1A1MAPTMAPK1SMN1; SMN2HTT
SCHEMBL15628442 0.83 ALDH1A1 (0.46) ALDH1A1KDM4ERORC
SCHEMBL12330921 0.81 HIF1A (0.44) ALDH1A1MAPTL3MBTL1KDM4EALOX15
SCHEMBL15628549 0.80 DPP4 (0.35) —
SCHEMBL15628606 0.80 DPP4 (0.35) —

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-20180094016-A1 Triazole Compounds And Methods Of Making And Using The Same BioVersys AG (CH) 2018-04-05 — — US disclosed
WO-2008143729-A2 MACROLIDE COMPOUNDS AND METHODS OF MAKING AND USING THE SAME RIB-X PHARMACEUTICALS, INC. (US) 2008-11-27 — — 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-20180094016-A1 Triazole Compounds And Methods Of Making And Using The Same IL33, PROKR1, VIP ALDH1A1 3532/4885MAPT 3970/4885L3MBTL1 3531/4885

“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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