SCHEMBL752017

SCHEMBL752017

O=C(Nc1[c]cccc1)NC1CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MEN1 O00255 2/20 0.50
HTT P42858 1/20 0.50
RAB9A P51151 5/20 0.49
EPHX1 P07099 4/20 0.49
EPHX2 P34913 1/20 0.49
ALDH1A1 P00352 6/20 0.46
HPGD P15428 2/20 0.46
GFER P55789 2/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.45
ALOX15 P16050 1/20 0.45
HSD17B10 Q99714 1/20 0.45
NPC1 O15118 3/20 0.44
PKM P14618 1/20 0.44
KDM4E B2RXH2 2/20 0.43
TP53 P04637 1/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42

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
SCHEMBL3760383 0.94 KMT2A (0.59) KMT2ASMN1; SMN2MEN1HTTRAB9A
SCHEMBL9725165 0.82 SMN1; SMN2 (0.44) KMT2ASMN1; SMN2MEN1HTTRAB9A
SCHEMBL1921108 0.76 GAA (0.49) KMT2ASMN1; SMN2MEN1HTTRAB9A
SCHEMBL3996276 0.75 SMN1; SMN2 (0.53) KMT2ASMN1; SMN2RAB9AEPHX1EPHX2
SCHEMBL3754787 0.74 SMN1; SMN2 (0.63) KMT2ASMN1; SMN2MEN1HTTRAB9A
SCHEMBL3769622 0.73 HPGD (0.56) SMN1; SMN2RAB9AALDH1A1HPGDHSD17B10
SCHEMBL7044143 0.73 HPGD (0.51) KMT2ASMN1; SMN2MEN1RAB9AALDH1A1
SCHEMBL10825858 0.73 EPHX1 (0.83) KMT2ASMN1; SMN2MEN1HTTRAB9A
SCHEMBL15263046 0.73 EPHX1 (0.83) KMT2ASMN1; SMN2MEN1HTTRAB9A
SCHEMBL1990596 0.72 NPC1 (0.49) KMT2ASMN1; SMN2MEN1HTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2430013-B1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC (US) 2014-10-15 EP claimed
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 US claimed
EP-2430013-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS Amgen, Inc (US) 2012-03-21 EP claimed
WO-2010132598-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC. (US) 2010-11-18 WO claimed
EP-2430013-B1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC (US) 2014-10-15 EP disclosed
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 US disclosed
EP-2430013-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS Amgen, Inc (US) 2012-03-21 EP disclosed
WO-2010132598-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC. (US) 2010-11-18 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-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors PIK3CA, PIKFYVE, PIK3CD KMT2A 2120/4885SMN1; SMN2 3999/4885MEN1 2197/4885

“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.