SCHEMBL3569923

SCHEMBL3569923

CCCNC(=O)C(Cl)C(=O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 3/20 0.57
HSP90AA1 P07900 2/20 0.57
GAA P10253 2/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
GPR55 Q9Y2T6 2/20 0.51
KMT2A Q03164 2/20 0.51
ALDH1A1 P00352 2/20 0.51
MEN1 O00255 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.46
NAAA Q02083 3/20 0.44
PGR P06401 1/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2B P18089 1/20 0.42
HTR2A P28223 1/20 0.42
HRH1 P35367 1/20 0.42
KCNH2 Q12809 1/20 0.42
P4HB P07237 1/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 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
SCHEMBL3574089 0.82 KMT2A (0.67) KMT2AL3MBTL1NAAAPGRADRA2A
SCHEMBL2358014 0.74 ATM (0.64) ATMHSP90AA1GAANPC1RAB9A
SCHEMBL334957 0.73 NAAA (0.73) GAANPC1RAB9AKMT2AALDH1A1
Benzene SCHEMBL28248159 0.73 NAAA (0.73) GAANPC1RAB9AKMT2AALDH1A1
SCHEMBL11257733 0.73 ATM (1.00) ATMHSP90AA1GAANPC1RAB9A
SCHEMBL6432979 0.73 CNR1 (0.69) RAB9AKMT2AALDH1A1MEN1HTT
SCHEMBL8172221 0.72 LMNA (0.59) ATMHSP90AA1GAANPC1RAB9A
Benzoin SCHEMBL20895768 0.72 LMNA (0.64) NPC1RAB9AALDH1A1L3MBTL1NAAA
SCHEMBL3728429 0.72 SLC6A2 (0.54) ATMHSP90AA1GAANPC1RAB9A
SCHEMBL11338329 0.72 NAAA (0.71) GAANPC1RAB9AKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1742904-B1 SUBSTITUTED ENAMINONES, THEIR DERIVATIVES AND USES THEREOF UNIV CALIFORNIA (US) 2012-10-31 EP disclosed
US-7825278-B2 Substituted enaminones, their derivatives and uses thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-11-02 US disclosed
US-20080064748-A1 Substituted enaminones, their derivatives and uses thereof OXFORD FINANCE CORPORATION 2008-03-13 US disclosed
EP-1742904-A4 SUBSTITUTED ENAMINONES, THEIR DERIVATIVES AND USES THEREOF UNIV CALIFORNIA (US) 2007-04-18 EP disclosed
EP-1742904-A2 SUBSTITUTED ENAMINONES, THEIR DERIVATIVES AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-01-17 EP disclosed
WO-2005108347-A2 SUBSTITUTED ENAMINONES, THEIR DERIVATIVES AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2005-11-17 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-20080064748-A1 Substituted enaminones, their derivatives and uses thereof GABRB2, GABRB1, GABRB3 ATM 3795/4885HSP90AA1 1916/4885GAA 1377/4885

“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.