SCHEMBL21792334

SCHEMBL21792334

Oc1nnc(-c2cc(Cl)c3c(c2)CCCO3)o1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 3/20 0.62
▸ METAP2 P50579 2/20 0.34
▸ RAB9A P51151 4/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.34
▸ LMNA P02545 2/20 0.34
▸ SAE1 Q9UBE0 1/20 0.34
▸ UBA2 Q9UBT2 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ MAPT P10636 3/20 0.34
▸ TDP1 Q9NUW8 3/20 0.34
▸ HTT P42858 2/20 0.34
▸ AXL P30530 1/20 0.34
▸ MERTK Q12866 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ HTR4 Q13639 5/20 0.33
▸ ADCY8 P40145 1/20 0.33
▸ ADCY1 Q08828 1/20 0.33

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
SCHEMBL21776965 0.75 NOTUM (0.60) NOTUMMETAP2AXLMERTKGSK3B
SCHEMBL21777014 0.72 NOTUM (0.34) NOTUMMETAP2LMNAL3MBTL1KDM4E
SCHEMBL21777035 0.70 NOTUM (0.63) NOTUMMETAP2
SCHEMBL21777037 0.69 NOTUM (0.62) NOTUM
SCHEMBL23505785 0.69 NOTUM (0.49) NOTUM
SCHEMBL17348468 0.66 NOTUM (0.47) NOTUMRAB9ASMN1; SMN2NPC1
SCHEMBL23451758 0.66 NOTUM (0.60) NOTUMMETAP2RAB9ASMN1; SMN2KDM4E
SCHEMBL11119325 0.66 NOTUM (0.47) NOTUMMAPT
SCHEMBL14742501 0.66 KMO (0.52) NOTUM
SCHEMBL17030608 0.65 NOTUM (0.46) NOTUMAXLMERTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11634391-B2 Compounds which are inhibitors of Notum UCL BUSINESS LTD (GB) 2023-04-25 — — US disclosed
US-20210171475-A1 COMPOUNDS UCL BUSINESS LTD (GB) 2021-06-10 — — US disclosed
US-20210171475-A1 COMPOUNDS UCL BUSINESS LTD (GB) 2021-06-10 — — US disclosed
WO-2020043866-A1 COMPOUNDS UCL BUSINESS LTD (GB) 2020-03-05 — — 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 (2 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-11634391-B2 Compounds which are inhibitors of Notum NOTUM, GOT2, GOT1 NOTUM 1/4885METAP2 1223/4885RAB9A 2177/4885
US-20210171475-A1 COMPOUNDS GOT2, GOT1, OAT NOTUM 5/4885METAP2 2776/4885RAB9A 1162/4885

“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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