SCHEMBL23451975

SCHEMBL23451975

Oc1nnc(-c2ccc3c(c2)OCCO3)o1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 10/20 0.63
▸ NOTUM Q6P988 1/20 0.55
▸ NPC1 O15118 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ ADCY1 Q08828 1/20 0.53

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 0.80 NOTUM (0.60) METAP2NOTUM
SCHEMBL12170980 0.77 NPC1 (0.60) NPC1RAB9ASMN1; SMN2ADCY1
SCHEMBL21777038 0.77 NOTUM (0.62) METAP2NOTUM
SCHEMBL3492339 0.77 NPC1 (0.81) NPC1RAB9ASMN1; SMN2
SCHEMBL28723457 0.75 GSK3A (0.62) METAP2NPC1RAB9ASMN1; SMN2ADCY1
SCHEMBL30816136 0.75 GSK3A (0.62) METAP2NPC1RAB9ASMN1; SMN2ADCY1
SCHEMBL23451538 0.74 NOTUM (0.57) METAP2NOTUMNPC1RAB9ASMN1; SMN2
SCHEMBL12871205 0.74 STIM1 (0.64) NPC1RAB9ASMN1; SMN2ADCY1
SCHEMBL15677665 0.73 ALOX5 (0.72) NOTUMNPC1RAB9ASMN1; SMN2
SCHEMBL21776892 0.73 NOTUM (0.61) METAP2NOTUMNPC1RAB9ASMN1; SMN2

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-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

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 METAP2 1223/4885NOTUM 1/4885NPC1 51/4885
US-20210171475-A1 COMPOUNDS GOT2, GOT1, OAT METAP2 2776/4885NOTUM 5/4885NPC1 7/4885

“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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