SCHEMBL2308019

SCHEMBL2308019

Cc1ccc(-c2ccncc2)o1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.55
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HSD17B10 Q99714 3/20 0.46
TP53 P04637 2/20 0.46
NPC1 O15118 2/20 0.46
GAA P10253 2/20 0.46
HPGD P15428 2/20 0.46
RAB9A P51151 2/20 0.46
MEN1 O00255 1/20 0.46
STAT1 P42224 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPT P10636 4/20 0.43
LMNA P02545 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
PTK2 Q05397 1/20 0.43
PKM P14618 1/20 0.43
ADORA3 P0DMS8 2/20 0.43
ADORA2A P29274 2/20 0.43

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
SCHEMBL17920649 0.83 LMNA (0.56) GSK3BKDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL23197679 0.83 TDP1 (0.56) GSK3BKDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL3077231 0.77 ADORA2A (0.48) GSK3BKDM4EALDH1A1HSD17B10GAA
SCHEMBL2319851 0.76 TDP1 (0.48) GSK3BKDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL2199459 0.76 PTGS1 (0.55) KDM4EALDH1A1SMN1; SMN2HSD17B10NPC1
SCHEMBL13680521 0.75 CYP2A6 (0.57) KDM4EALDH1A1HSD17B10NPC1HPGD
SCHEMBL12669250 0.74 TDP1 (0.46) GSK3BKDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL12578009 0.74 TDP1 (0.67) GSK3BKDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL14781240 0.73 KDM4E (0.46) GSK3BKDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL5539598 0.73 GSK3B (0.57) GSK3BKDM4EALDH1A1SMN1; SMN2HSD17B10

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150291623-A1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2015-10-15 US claimed
US-20120295897-A1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2012-11-22 US claimed
EP-2350090-A2 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS Xenon Pharmaceuticals Inc. (CA) 2011-08-03 EP claimed
US-20100137299-A1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2010-06-03 US claimed
WO-2010045251-A2 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS, INC. (CA) 2010-04-22 WO claimed
EP-2934538-B1 FACTOR IXA INHIBITORS MERCK SHARP & DOHME (US) 2021-03-31 EP disclosed
US-9932330-B2 Piperazine derivatives for treating disorders THE UNIVERSITY OF NOTTINGHAM (GB) 2018-04-03 US disclosed
US-20180044331-A1 PIPERAZINE DERIVATIVES FOR TREATING DISORDERS EXONATE LIMITED (GB) 2018-02-15 US disclosed
US-9796707-B2 Piperazine derivatives for treating disorders THE UNIVERSITY OF NOTTINGHAM (GB) 2017-10-24 US disclosed
US-20170267670-A1 PIPERAZINE DERIVATIVES FOR TREATING DISORDERS EXONATE LIMITED (GB) 2017-09-21 US disclosed
US-9708308-B2 Factor IXa inhibitors MERCK SHARP DOHME CORP. (US) 2017-07-18 US disclosed
US-9695160-B2 Piperazine derivatives for treating disorders THE UNIVERSITY OF NOTTINGHAM (GB) 2017-07-04 US disclosed
WO-2014120346-A1 FACTOR IXA INHIBITORS MERCK SHARP & DOHME CORP. (US) 2014-08-07 WO disclosed
US-20130252962-A1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC (CA) 2013-09-26 US disclosed
US-8415370-B2 Spiro-oxindole compounds and their uses as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2013-04-09 US disclosed
US-20120295897-A1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2012-11-22 US disclosed
US-8263606-B2 Spiro-oxindole compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2012-09-11 US disclosed
EP-2350090-A2 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS Xenon Pharmaceuticals Inc. (CA) 2011-08-03 EP disclosed
US-20100137299-A1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2010-06-03 US disclosed
WO-2010045251-A2 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS, INC. (CA) 2010-04-22 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 (6 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-20130252962-A1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS TRPV3, TRPV1, TRPC3 GSK3B 350/4885KDM4E 4619/4885ALDH1A1 1020/4885
US-20180044331-A1 PIPERAZINE DERIVATIVES FOR TREATING DISORDERS PGF, GAP43, VHL GSK3B 2935/4885KDM4E 2903/4885ALDH1A1 1203/4885
US-20150291623-A1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS TRPV3, TRPV1, TRPC3 GSK3B 350/4885KDM4E 4619/4885ALDH1A1 1020/4885
US-20170267670-A1 PIPERAZINE DERIVATIVES FOR TREATING DISORDERS PGF, GAP43, VHL GSK3B 2935/4885KDM4E 2903/4885ALDH1A1 1203/4885
US-20120295897-A1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS TRPV3, TRPC3, TRPV1 GSK3B 360/4885KDM4E 4646/4885ALDH1A1 1005/4885
US-20100137299-A1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS TRPV3, TRPV1, TRPC3 GSK3B 350/4885KDM4E 4619/4885ALDH1A1 1020/4885

“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.