SCHEMBL21801490

SCHEMBL21801490

Cc1c(-c2nnc(Nc3ccc(F)cc3)o2)[nH]c2ccc(Cl)cc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ QPCT Q16769 2/20 0.44
▸ GSK3B P49841 5/20 0.41
▸ BCL2 P10415 3/20 0.41
▸ IDO1 P14902 1/20 0.40
▸ TDO2 P48775 1/20 0.40
▸ KDR P35968 2/20 0.38
▸ CA12 O43570 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ FLT1 P17948 1/20 0.38
▸ CNR1 P21554 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ MAPT P10636 1/20 0.35
▸ ADCY1 Q08828 1/20 0.35

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
SCHEMBL21801499 0.89 BCL2 (0.50) QPCTGSK3BBCL2CA12CA1
SCHEMBL21801558 0.86 CNR1 (0.43) QPCTGSK3BBCL2KDRCA12
SCHEMBL21801541 0.76 QPCT (0.47) QPCTGSK3BBCL2KDRCA12
SCHEMBL21801461 0.76 MAPK1 (0.50) QPCTGSK3BKDM4ENPC1ALDH1A1
SCHEMBL21801500 0.75 CDC7 (0.50) QPCTCNR1
SCHEMBL21801464 0.75 BCL2 (0.47) QPCTGSK3BBCL2CA12CA1
SCHEMBL21801503 0.75 LMNA (0.40) KDM4ENPC1ALDH1A1LMNAHPGD
SCHEMBL21801555 0.74 PTGS2 (0.49) CNR1NPC1RAB9A
SCHEMBL21801468 0.74 QPCT (0.42) QPCTGSK3BBCL2KDRFLT1
SCHEMBL24750230 0.73 PTGS2 (0.46) CNR1NPC1LMNARAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220257569-A1 INDOLE-OXADIAZOLE COMPOUNDS AND THEIR THERAPEUTIC USE THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2022-08-18 — — US disclosed
WO-2020051707-A1 INDOLE-OXADIAZOLE COMPOUNDS AND THEIR THERAPEUTIC USE THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2020-03-19 — — 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 (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-20220257569-A1 INDOLE-OXADIAZOLE COMPOUNDS AND THEIR THERAPEUTIC USE CNR2, GPR119, CNR1 QPCT 2631/4885GSK3B 116/4885BCL2 935/4885

“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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