SCHEMBL20803950

SCHEMBL20803950

CC(C)c1ccc(CNC2COC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ ALOX12 P18054 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ POLB P06746 1/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39

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
SCHEMBL16980401 0.84 RAB9A (0.53) L3MBTL1POLBRAB9ANPC1HRH3
SCHEMBL14850003 0.83 SMN1; SMN2 (0.49) SMN1; SMN2L3MBTL1KDM4EALDH1A1GAA
SCHEMBL19008152 0.81 BACE1 (0.52) ALDH1A1
SCHEMBL16980536 0.81 POLB (0.59) SMN1; SMN2L3MBTL1ALDH1A1POLBRAB9A
SCHEMBL20804106 0.80 ACHE (0.49) SMN1; SMN2L3MBTL1KDM4EALDH1A1GAA
SCHEMBL17335871 0.79 HRH3 (0.66) SMN1; SMN2KDM4EALDH1A1POLBRAB9A
SCHEMBL19008146 0.78 MAP4K4 (0.44) ALDH1A1
SCHEMBL8338757 0.77 GRIN2B (0.54) L3MBTL1ALDH1A1RAB9ANPC1MEN1
SCHEMBL14866687 0.77 L3MBTL1 (0.46) SMN1; SMN2L3MBTL1KDM4EALDH1A1GAA
SCHEMBL20528646 0.76 GRIN2B (0.56) RAB9AMEN1KMT2A

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-10633350-B2 Diphenyl derivatives and uses thereof NOVARTIS AG (CH) 2020-04-28 — — US disclosed
US-20190077773-A1 DIPHENYL DERIVATIVES AND USES THEREOF NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2019-03-14 — — 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 (2 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-20190077773-A1 DIPHENYL DERIVATIVES AND USES THEREOF MYOF, NGF, MUSK SMN1; SMN2 7/4885L3MBTL1 1366/4885KDM4E 2168/4885
US-10633350-B2 Diphenyl derivatives and uses thereof MYOF, NGF, MUSK SMN1; SMN2 7/4885L3MBTL1 1366/4885KDM4E 2168/4885

“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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