SCHEMBL22823000

SCHEMBL22823000

CN[C@H]1C[C@H](n2c(C)cc3ccc(N4CCN(c5ccc(C(C)=O)cc5)CC4)nc32)C1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ TP53 P04637 1/20 0.43
▸ MAPT P10636 6/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ JAK2 O60674 3/20 0.37
▸ FLT3 P36888 3/20 0.37
▸ POLB P06746 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36

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
SCHEMBL21273978 0.87 MAPT (0.41) KMT2AMEN1TP53MAPTSMN1; SMN2
SCHEMBL21273982 0.87 MAPT (0.41) KMT2AMEN1TP53MAPTSMN1; SMN2
SCHEMBL21285512 0.83 KMT2A (0.43) KMT2AMEN1TP53MAPTSMN1; SMN2
SCHEMBL21285522 0.82 MAPT (0.39) KMT2AMEN1TP53MAPTSMN1; SMN2
SCHEMBL22822491 0.82 MAPT (0.39) KMT2AMEN1TP53MAPTSMN1; SMN2
SCHEMBL21274294 0.81 MAPT (0.38) KMT2AMEN1TP53MAPTSMN1; SMN2
SCHEMBL21285529 0.81 MAPT (0.38) KMT2AMEN1TP53MAPTSMN1; SMN2
SCHEMBL21274292 0.81 MAPT (0.38) KMT2AMEN1TP53MAPTSMN1; SMN2
SCHEMBL21273994 0.80 MAPT (0.37) KMT2AMEN1TP53MAPTSMN1; SMN2
SCHEMBL21274081 0.80 MAPT (0.37) KMT2AMEN1TP53MAPTSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200399268-A1 Pharmaceutical 6,5 Heterobicyclic Ring Derivatives EVOTEC (UK) LTD (GB) 2020-12-24 — — 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-20200399268-A1 Pharmaceutical 6,5 Heterobicyclic Ring Derivatives STING1, IRF3, NFATC1 KMT2A 4561/4885MEN1 3236/4885TP53 3535/4885

“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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