SCHEMBL284342

SCHEMBL284342

CC(=O)N[C@H]1CC[C@H](NC(C)=O)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.56
ALDH1A1 P00352 3/20 0.52
KDM4E B2RXH2 2/20 0.52
EPHX2 P34913 2/20 0.48
MMP2 P08253 1/20 0.46
MMP8 P22894 1/20 0.46
MTNR1A P48039 1/20 0.45
MTNR1B P49286 1/20 0.45
EPHX1 P07099 6/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 1/20 0.43
CYP3A4 P08684 1/20 0.43
POLB P06746 1/20 0.42
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
TLR4 O00206 1/20 0.41
CA12 O43570 1/20 0.41
CA9 Q16790 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
SCHEMBL284319 1.00 ATM (0.56) ATMALDH1A1KDM4EEPHX2MMP2
SCHEMBL50350 1.00
SCHEMBL284318 1.00 ATM (0.56) ATMALDH1A1KDM4EEPHX2MMP2
Hydrochloric Acid SCHEMBL27752288 0.97
Water SCHEMBL27364290 0.97
Nitrogen SCHEMBL27858935 0.94
Bicarbonate SCHEMBL11027352 0.94 ATM (0.52) ATMALDH1A1KDM4EEPHX2MMP2
SCHEMBL23735497 0.92 EPHX2 (0.61) ATMALDH1A1KDM4EEPHX2MTNR1A
SCHEMBL21088500 0.92 ATM (0.50) ATMALDH1A1KDM4EEPHX2MMP2
SCHEMBL942931 0.89 EPHX2 (0.65) ATMALDH1A1KDM4EEPHX2MMP2

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
US-20120077120-A1 PHOTORESISTS COMPRISING MULTI-AMIDE COMPONENT ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2012-03-29 US claimed
EP-2428842-A1 Photoresists comprising multi-amide component Rohm and Haas Electronic Materials LLC (US) 2012-03-14 EP claimed
US-20120077120-A1 PHOTORESISTS COMPRISING MULTI-AMIDE COMPONENT ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2012-03-29 US disclosed
EP-2428842-A1 Photoresists comprising multi-amide component Rohm and Haas Electronic Materials LLC (US) 2012-03-14 EP disclosed
US-7803804-B2 Substituted pyrazines for use in the treatment of inflammatory or allergic conditions NOVARTIS AG (CH) 2010-09-28 US disclosed
US-7803804-B2 Substituted pyrazines for use in the treatment of inflammatory or allergic conditions NOVARTIS AG (CH) 2010-09-28 US disclosed
US-20080312217-A1 Organic Compounds NOVARTIS AG 2008-12-18 US disclosed
US-20080312217-A1 Organic Compounds NOVARTIS AG 2008-12-18 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 (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-20080312217-A1 Organic Compounds TRPA1, TRPV1, CHRM1 ATM 3594/4885ALDH1A1 567/4885KDM4E 4641/4885

“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.