SCHEMBL2228615

SCHEMBL2228615

O=c1c(CO)cnc2ccccn12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 10/20 0.48
ALDH1A1 P00352 9/20 0.48
NPC1 O15118 9/20 0.48
RAB9A P51151 9/20 0.48
KDM4E B2RXH2 6/20 0.48
HPGD P15428 5/20 0.48
GAA P10253 3/20 0.48
GLA P06280 2/20 0.48
HSD17B10 Q99714 3/20 0.46
TSHR P16473 2/20 0.46
ADORA3 P0DMS8 1/20 0.46
MAPT P10636 3/20 0.46
TP53 P04637 3/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
POLB P06746 1/20 0.46
PKM P14618 2/20 0.46
LMNA P02545 2/20 0.45
GGPS1 O95749 1/20 0.44
FDPS P14324 1/20 0.44

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
SCHEMBL14161794 0.85 MAPT (0.48) SMN1; SMN2ALDH1A1NPC1RAB9AKDM4E
SCHEMBL12531879 0.83 ADORA3 (0.46) SMN1; SMN2ALDH1A1NPC1RAB9AKDM4E
SCHEMBL30431911 0.81 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1NPC1RAB9AKDM4E
SCHEMBL14161884 0.81 MAPT (0.48) SMN1; SMN2ALDH1A1NPC1RAB9AKDM4E
SCHEMBL30432313 0.80 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1NPC1RAB9AKDM4E
SCHEMBL14161883 0.78 MAPT (0.56) SMN1; SMN2ALDH1A1NPC1RAB9AKDM4E
SCHEMBL6921004 0.76 KDM4E (0.40) SMN1; SMN2ALDH1A1NPC1RAB9AKDM4E
SCHEMBL30433046 0.76 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1NPC1RAB9AKDM4E
SCHEMBL9797098 0.75 GGPS1 (0.56) SMN1; SMN2ALDH1A1NPC1RAB9AKDM4E
SCHEMBL8517029 0.75 GAA (0.49) ALDH1A1KDM4EHPGDGAAGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12162863-B2 Modulators of stimulator of interferon genes (STING) Ryvu Therapeutics S.A. (PL) 2024-12-10 US disclosed
US-20220402898-A1 MODULATORS OF STIMULATOR OF INTERFERON GENES (STING) Ryvu Therapeutics S.A. (PL) 2022-12-22 US disclosed
US-20220402898-A1 MODULATORS OF STIMULATOR OF INTERFERON GENES (STING) Ryvu Therapeutics S.A. (PL) 2022-12-22 US disclosed
EP-3807264-A1 MODULATORS OF STIMULATOR OF INTERFERON GENES (STING) Ryvu Therapeutics S.A. (PL) 2021-04-21 EP disclosed
WO-2019238786-A1 MODULATORS OF STIMULATOR OF INTERFERON GENES (STING) Ryvu Therapeutics S.A. (PL) 2019-12-19 WO disclosed
WO-2019238786-A1 MODULATORS OF STIMULATOR OF INTERFERON GENES (STING) Ryvu Therapeutics S.A. (PL) 2019-12-19 WO disclosed
US-8785452-B2 Anti-infective compounds INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 2014-07-22 US disclosed
US-20130012506-A1 ANTI-INFECTIVE PYRIDO (1,2-A) PYRIMIDINES NO ZAESUNG (KR) 2013-01-10 US disclosed
WO-2011089457-A1 NOVEL MEDICINAL COMPOUNDS URATIM GYÁRTÓ KORLÁTOLT FELELŐSSÉGŰ TÁRSASÁG (HU) 2011-07-28 WO disclosed
US-20110178077-A1 Anti-infective compounds INSTITUT PASTEUR KOREA (KR) 2011-07-21 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 (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-12162863-B2 Modulators of stimulator of interferon genes (STING) STING1, IRF3, CGAS SMN1; SMN2 3753/4885ALDH1A1 4462/4885NPC1 2744/4885
US-20220402898-A1 MODULATORS OF STIMULATOR OF INTERFERON GENES (STING) STING1, IRF3, CGAS SMN1; SMN2 3753/4885ALDH1A1 4462/4885NPC1 2744/4885
US-20110178077-A1 Anti-infective compounds RABGGTB, ELANE, SERPINB1 SMN1; SMN2 4839/4885ALDH1A1 3932/4885NPC1 402/4885
US-20130012506-A1 ANTI-INFECTIVE PYRIDO (1,2-A) PYRIMIDINES TYMS, TYMP, DCTPP1 SMN1; SMN2 4530/4885ALDH1A1 2522/4885NPC1 2555/4885

“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.