SCHEMBL13448704

SCHEMBL13448704

CC(=O)NC1(C(N)=O)CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HTT P42858 1/20 0.38
MAPT P10636 1/20 0.35
P2RX7 Q99572 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.33
CRBN Q96SW2 1/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
LMNA P02545 1/20 0.31
OPRL1 P41146 1/20 0.31
CNR2 P34972 1/20 0.30
TAS2R38 P59533 1/20 0.30

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
SCHEMBL2847319 0.98 KDM4E (0.41) ALDH1A1SMN1; SMN2KMT2AKDM4EHTT
SCHEMBL9613266 0.93 KDM4E (0.41) ALDH1A1SMN1; SMN2KMT2AKDM4EHTT
SCHEMBL2839884 0.89 KDM4E (0.43) ALDH1A1SMN1; SMN2KMT2AKDM4EHTT
SCHEMBL1957150 0.80 KDM4E (0.36) ALDH1A1SMN1; SMN2KMT2AKDM4EMAPT
SCHEMBL3704763 0.80 FFAR3 (0.39) ALDH1A1HTTMAPTL3MBTL1CNR2
SCHEMBL32690599 0.79 KDM4E (0.39) ALDH1A1SMN1; SMN2KMT2AKDM4EMAPT
SCHEMBL18614593 0.79 KDM4E (0.37) KMT2AKDM4ECRBN
SCHEMBL30389190 0.78 SPHK1 (0.37) ALDH1A1SMN1; SMN2KMT2AKDM4EMAPT
SCHEMBL7408898 0.78 KDM4E (0.36) ALDH1A1KMT2AKDM4E
SCHEMBL4928521 0.77 KDM4E (0.38) ALDH1A1SMN1; SMN2KMT2AKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9556117-B2 Indole carboxamide derivatives as P2X7 receptor antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2017-01-31 US claimed
EP-2935211-B1 INDOLE CARBOXAMIDE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2016-11-09 EP claimed
US-20150344425-A1 INDOLE CARBOXAMIDE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2015-12-03 US claimed
EP-3402469-B1 P2X7 RECEPTOR ANTAGONISTS FOR RESTORING T-CELL LYMPHOPOIESIS IN SUBJECTS INFECTED WITH HUMAN IMMUNODEFICIENCY VIRUS (HIV) INST NAT SANTE RECH MED (FR) 2021-01-06 EP disclosed
US-10548980-B2 P2X7 receptor antagonists for restoring T-cell lymphopoiesis in subjects infected with human immunodeficiency virus (HIV) INSERM (Institut National de la Santé et de la Recherche Médicale (FR) 2020-02-04 US disclosed
US-20190022223-A1 P2X7 RECEPTOR ANTAGONISTS FOR RESTORING T-CELL LYMPHOPOIESIS IN SUBJECTS INFECTED WITH HUMAN IMMUNODEFICIENCY VIRUS (HIV) INSERM (INSTITUT NATIONAL DE LA SANTÉ ET LA SANTÉ ET DE LA RECHERCHE MÉDICALE) (FR) 2019-01-24 US disclosed
US-20180305341-A1 IMIDAZOLINONE DERIVATIVES AS TRPM8 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2018-10-25 US disclosed
EP-3350171-A1 IMIDAZOLINONE DERIVATIVES AS TRPM8 ANTAGONISTS RaQualia Pharma Inc. (JP) 2018-07-25 EP disclosed
WO-2017043092-A1 IMIDAZOLINONE DERIVATIVES AS TRPM8 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2017-03-16 WO disclosed
US-9556117-B2 Indole carboxamide derivatives as P2X7 receptor antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2017-01-31 US disclosed
EP-2935211-B1 INDOLE CARBOXAMIDE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2016-11-09 EP disclosed
US-20150344425-A1 INDOLE CARBOXAMIDE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2015-12-03 US disclosed
EP-2935211-A1 INDOLE CARBOXAMIDE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS Actelion Pharmaceuticals Ltd. (CH) 2015-10-28 EP disclosed
WO-2014097140-A1 INDOLE CARBOXAMIDE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2014-06-26 WO disclosed
WO-2010031820-A1 GLUCOSIDE DERIVATIVES AND USES THEREOF AS SGLT INHIBITORS NOVARTIS AG (CH) 2010-03-25 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 (4 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-10548980-B2 P2X7 receptor antagonists for restoring T-cell lymphopoiesis in subjects infected with human immunodeficiency virus (HIV) P2RX7, P2RX1, P2RX5 ALDH1A1 2862/4885SMN1; SMN2 4035/4885KMT2A 3009/4885
US-20150344425-A1 INDOLE CARBOXAMIDE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS P2RX7, P2RX3, P2RX1 ALDH1A1 2019/4885SMN1; SMN2 4518/4885KMT2A 2092/4885
US-20180305341-A1 IMIDAZOLINONE DERIVATIVES AS TRPM8 ANTAGONISTS TRPM8, TRPM7, TRPM5 ALDH1A1 2066/4885SMN1; SMN2 2031/4885KMT2A 2789/4885
US-20190022223-A1 P2X7 RECEPTOR ANTAGONISTS FOR RESTORING T-CELL LYMPHOPOIESIS IN SUBJECTS INFECTED WITH HUMAN IMMUNODEFICIENCY VIRUS (HIV) P2RX7, P2RX1, P2RX5 ALDH1A1 2862/4885SMN1; SMN2 4035/4885KMT2A 3009/4885

“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.