SCHEMBL29808087

SCHEMBL29808087

Cc1ccnc(SCc2nc(-c3ccccc3)oc2C)n1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.49
▸ HPGD P15428 2/20 0.47
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ MAPT P10636 4/20 0.46
▸ THRB P10828 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ HRH3 Q9Y5N1 1/20 0.44
▸ RXFP1 Q9HBX9 2/20 0.43
▸ PPARG P37231 1/20 0.43
▸ PPARA Q07869 1/20 0.43
▸ KDR P35968 1/20 0.42
▸ POLB P06746 1/20 0.42

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
SCHEMBL27218889 0.80 MAPT (0.48) KDM4EHPGDNPC1RAB9ASMN1; SMN2
SCHEMBL29808208 0.80 HPGD (0.54) KDM4EHPGDNPC1RAB9ASMN1; SMN2
SCHEMBL29808182 0.77 NOTUM (0.48) KDM4EHPGDNPC1RAB9ASMN1; SMN2
SCHEMBL5695138 0.74 HSD17B10 (0.65) KDM4ENPC1RAB9ASMN1; SMN2ALOX15
SCHEMBL266619 0.74 KDM4E (0.66) KDM4EHPGDNPC1RAB9AHRH3
SCHEMBL6568991 0.72 KDM4E (0.59) KDM4EHPGDNPC1RAB9AHRH3
SCHEMBL29807808 0.72 TSHR (0.61) NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL9316495 0.71 MAPT (0.53) KDM4EHPGDMAPTPOLB
SCHEMBL29808180 0.70 SMN1; SMN2 (0.57) KDM4EHPGDNPC1RAB9ASMN1; SMN2
SCHEMBL4037331 0.70 KDM4E (0.69) KDM4EHPGDNPC1RAB9AHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220274968-A1 Oxazole And Oxadiazole Derivatives Useful As Agonists Of Free Fatty Acid Receptor 1 GBIOTECH S.À.R.L. (CH) 2022-09-01 — — 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-20220274968-A1 Oxazole And Oxadiazole Derivatives Useful As Agonists Of Free Fatty Acid Receptor 1 FFAR2, FFAR1, FFAR3 KDM4E 3951/4885HPGD 1443/4885NPC1 2356/4885

“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.

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