SCHEMBL29336679

SCHEMBL29336679

COC(=O)c1cccc(Oc2ccc3[nH]ccc3c2)c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ XDH P47989 1/20 0.51
▸ CDK8 P49336 1/20 0.49
▸ MET P08581 1/20 0.47
▸ ALK Q9UM73 1/20 0.47
▸ MAOA P21397 1/20 0.46
▸ NPC1 O15118 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ THRA P10827 2/20 0.45
▸ THRB P10828 2/20 0.45
▸ TP53 P04637 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ CTNNB1 P35222 1/20 0.43
▸ WNT3A P56704 1/20 0.43

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
SCHEMBL30285469 0.86 MAOA (0.53) KDRMAOAMAPTRAB9ATHRA
SCHEMBL29336889 0.86 MAOA (0.53) KDRMAOAMAPTRAB9ATHRA
SCHEMBL16741838 0.85 AKR1C3 (0.59) MAOANPC1MAPTRAB9ACTNNB1
SCHEMBL22169914 0.84 MET (0.49) L3MBTL1XDHCDK8METALK
SCHEMBL30967902 0.83 NPC1 (0.47) MAOANPC1MAPTRAB9ATHRA
SCHEMBL29237301 0.83 NPC1 (0.47) MAOANPC1MAPTRAB9ATHRA
SCHEMBL18941171 0.82 AR (0.61) L3MBTL1MAOANPC1MAPTRAB9A
SCHEMBL31176890 0.82 L3MBTL1 (0.55) KDRL3MBTL1CDK8METALK
SCHEMBL31176896 0.82 L3MBTL1 (0.55) KDRL3MBTL1CDK8METALK
SCHEMBL103794 0.81 TUBB4A (0.58) KDRCDK8MAOANPC1MAPT

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-20240239784-A1 INDOLE COMPOUNDS AND METHODS OF USE GENZYME CORPORATION 2024-07-18 — — US disclosed
US-20240239784-A1 INDOLE COMPOUNDS AND METHODS OF USE GENZYME CORPORATION 2024-07-18 — — 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-20240239784-A1 INDOLE COMPOUNDS AND METHODS OF USE CFTR, INMT, IDO1 KDR 4872/4885L3MBTL1 3265/4885XDH 362/4885

“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.

Send feedback