SCHEMBL2957050

SCHEMBL2957050

CCONCC(C)Cc1ccc(OC)c(OC)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.48
ALOX12 P18054 2/20 0.48
LDHA P00338 1/20 0.48
CA2 P00918 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
POLB P06746 3/20 0.43
ATM Q13315 2/20 0.43
FOS P01100 1/20 0.42
TTR P02766 1/20 0.42
JUN P05412 1/20 0.42
NR3C1 P04150 1/20 0.42
HSD17B1 P14061 1/20 0.42
HSD17B2 P37059 1/20 0.42
KDM4E B2RXH2 2/20 0.41
KDM1A O60341 1/20 0.41
CALM1 P0DP23 1/20 0.41
ALDH1A1 P00352 2/20 0.41
PPARG P37231 1/20 0.41
PPARD Q03181 1/20 0.41

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
SCHEMBL2958295 0.80 LDHA (0.55) ALOX15ALOX12LDHACA2MEN1
SCHEMBL23966140 0.79 LDHA (0.57) ALOX15ALOX12LDHACA2MEN1
SCHEMBL2951885 0.79 ALOX15 (0.50) ALOX15ALOX12LDHACA2MEN1
SCHEMBL2956217 0.78 ALOX15 (0.53) ALOX15ALOX12MEN1KMT2APOLB
SCHEMBL5494607 0.74 LDHA (0.60) ALOX15ALOX12LDHACA2POLB
SCHEMBL9026890 0.74 LDHA (0.60) ALOX15ALOX12LDHACA2KMT2A
SCHEMBL10558447 0.74 ATM (0.58) ALOX15ALOX12LDHACA2MEN1
Terameprocol SCHEMBL2356280 0.73 ALOX15 (0.77) ALOX15ALOX12LDHACA2POLB
Terameprocol SCHEMBL194588 0.73 ALOX15 (0.77) ALOX15ALOX12LDHACA2POLB
Terameprocol SCHEMBL10060164 0.73 ALOX15 (0.77) ALOX15ALOX12LDHACA2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1692096-B1 HYDROXYLAMINE DERIVATIVES NEWRON PHARM SPA (IT) 2013-04-03 EP claimed
US-7763751-B2 Hydroxylamine derivatives NEWRON PHARMACEUTICALS S.P.A. (IT) 2010-07-27 US claimed
US-20070049643-A1 Hydroxylamine derivatives VICURON PHARMACEUTICALS INC. 2007-03-01 US claimed
EP-1541547-A1 Hydroxylamine derivatives Newron Pharmaceuticals S.p.A. (IT) 2005-06-15 EP claimed
EP-1692096-B1 HYDROXYLAMINE DERIVATIVES NEWRON PHARM SPA (IT) 2013-04-03 EP disclosed
US-20100197799-A1 HYDROXYLAMINE DERIVATIVES NEWRON PHARMACEUTICALS S.P.A. (IT) 2010-08-05 US disclosed
US-7763751-B2 Hydroxylamine derivatives NEWRON PHARMACEUTICALS S.P.A. (IT) 2010-07-27 US disclosed
US-20070049643-A1 Hydroxylamine derivatives VICURON PHARMACEUTICALS INC. 2007-03-01 US disclosed
EP-1541547-A1 Hydroxylamine derivatives Newron Pharmaceuticals S.p.A. (IT) 2005-06-15 EP 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-20100197799-A1 HYDROXYLAMINE DERIVATIVES C9, C1S, HTT ALOX15 3845/4885ALOX12 3814/4885LDHA 3208/4885
US-20070049643-A1 Hydroxylamine derivatives C9, C1S, HTT ALOX15 3665/4885ALOX12 3652/4885LDHA 3199/4885

“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.