SCHEMBL893100

SCHEMBL893100

O=C(Nc1ccccc1)c1cocn1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2R P25116 1/20 0.64
POLB P06746 1/20 0.56
RAB9A P51151 4/20 0.54
NPC1 O15118 2/20 0.54
KDM4E B2RXH2 2/20 0.54
ALDH1A1 P00352 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.51
KDR P35968 2/20 0.49
CNR1 P21554 1/20 0.49
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49
EGFR P00533 1/20 0.48
KMT2A Q03164 1/20 0.47
P4HTM Q9NXG6 1/20 0.47
GAA P10253 1/20 0.47
HTT P42858 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
KCNK3 O14649 1/20 0.45
KCNK9 Q9NPC2 1/20 0.45

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
SCHEMBL18993441 0.83 F2R (0.51) F2RPOLBRAB9ANPC1KDM4E
SCHEMBL18027796 0.83 RAB9A (0.56) F2RPOLBRAB9ANPC1KDM4E
SCHEMBL9900079 0.82 F2R (0.63) F2RRAB9ANPC1KDM4EALDH1A1
SCHEMBL22362607 0.79 F2R (1.00) F2RRAB9ANPC1KMT2A
SCHEMBL28033119 0.78 SMN1; SMN2 (0.55) F2RPOLBRAB9ANPC1KDM4E
SCHEMBL30834279 0.76 RAB9A (0.73) POLBRAB9ANPC1KDM4EALDH1A1
SCHEMBL27786185 0.76 F2R (0.44) F2RPOLBRAB9ANPC1KDM4E
SCHEMBL15707391 0.75 F2R (0.53) F2RPOLBRAB9ANPC1SMN1; SMN2
SCHEMBL18207936 0.75 SORT1 (0.54) F2RRAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL15707278 0.74 CA1 (0.52) F2RKDR

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-20220133740-A1 VALPROIC ACID COMPOUNDS AND WNT AGONISTS FOR TREATING EAR DISORDERS Frequency Therapeutics, Inc. (US) 2022-05-05 US disclosed
US-20190054068-A1 Indole Amide Derivatives and Related Compounds for Use in the Treatment of Neurodegenerative Diseases REMYND (BE) 2019-02-21 US disclosed
EP-2822944-A1 OXAZOLIDINONE COMPOUNDS AND DERIVATIVES THEREOF AMGEN, INC. (US) 2015-01-14 EP disclosed
US-8618138-B2 Indole amide derivatives and related compounds for use in the treatment of neurodegenerative diseases KATHOLIEKE UNIVERSITEIT LEUVEN, K.U. LEUVEN R&D (BE) 2013-12-31 US disclosed
EP-2649068-A1 OXAZOLYL-METHYLETHER DERIVATIVES AS ALX RECEPTOR AGONISTS Actelion Pharmaceuticals Ltd. (CH) 2013-10-16 EP disclosed
WO-2013134079-A1 OXAZOLIDINONE COMPOUNDS AND DERIVATIVES THEREOF AMGEN INC. (US) 2013-09-12 WO disclosed
WO-2012077049-A1 OXAZOLYL-METHYLETHER DERIVATIVES AS ALX RECEPTOR AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2012-06-14 WO disclosed
US-20120083475-A1 INDOLE AMIDE DERIVATIVES AND RELATED COMPOUNDS FOR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES KATHOLIEKE UNIVERSITEIT LEUVEN, K.U. LEUVEN R&D (BE) 2012-04-05 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 (3 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-20120083475-A1 INDOLE AMIDE DERIVATIVES AND RELATED COMPOUNDS FOR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, MAPT, NLN F2R 3474/4885POLB 4300/4885RAB9A 1779/4885
US-20190054068-A1 Indole Amide Derivatives and Related Compounds for Use in the Treatment of Neurodegenerative Diseases SNCA, MAPT, NLN F2R 3474/4885POLB 4300/4885RAB9A 1779/4885
US-20220133740-A1 VALPROIC ACID COMPOUNDS AND WNT AGONISTS FOR TREATING EAR DISORDERS WNT3A, WNT1, WNT3 F2R 1502/4885POLB 4084/4885RAB9A 1342/4885

“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.