SCHEMBL23351083

SCHEMBL23351083

COc1ccc(CN(C)c2cc(Cl)nc3c(NC(=O)NCCOc4ccc(N)cc4)cnn23)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.47
▸ KMT2A Q03164 2/20 0.39
▸ ATM Q13315 1/20 0.39
▸ HCAR2 Q8TDS4 1/20 0.38
▸ TRPV1 Q8NER1 2/20 0.37
▸ CASR P41180 2/20 0.36
▸ PPIB P23284 1/20 0.35
▸ MTNR1A P48039 1/20 0.35
▸ MTNR1B P49286 1/20 0.35
▸ MAPK1 P28482 1/20 0.34
▸ CCR3 P51677 1/20 0.34
▸ CNR1 P21554 1/20 0.34
▸ FPR2 P25090 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ ALOX12 P18054 1/20 0.34

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
SCHEMBL29930766 0.93 LMNA (0.42) LMNAKMT2AATMHCAR2TRPV1
SCHEMBL23327453 0.93 LMNA (0.42) LMNAKMT2AATMHCAR2TRPV1
SCHEMBL23327491 0.86 TRPV1 (0.46) KMT2ATRPV1MAPK1CNR1FPR2
SCHEMBL23327703 0.84 KDM4E (0.36) KMT2ATRPV1MAPK1MAPT
SCHEMBL23327537 0.83 NR3C2 (0.38) KMT2A
SCHEMBL23327500 0.78 ALDH1A1 (0.43) KMT2AMAPT
SCHEMBL23351205 0.77 ALDH1A1 (0.35) LMNAKMT2A
SCHEMBL26098304 0.75 PTPN1 (0.49) KMT2AMAPT
SCHEMBL21811192 0.72 KDM4E (0.44) LMNAMAPT
SCHEMBL23327454 0.70 MAPT (0.42) LMNAMAPK1MAPT

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-11753411-B2 Substituted pyrazolo[1,5-a]pyrimidines as TYK2 pseudokinase ligands VENTYX BIOSCIENCES, INC. (US) 2023-09-12 — — US disclosed
US-20210139486-A1 TYK2 PSEUDOKINASE LIGANDS VENTYX BIOSCIENCES, INC. 2021-05-13 — — 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-11753411-B2 Substituted pyrazolo[1,5-a]pyrimidines as TYK2 pseudokinase ligands TYK2, JAK1, JAK2 LMNA 2097/4885KMT2A 819/4885ATM 494/4885
US-20210139486-A1 TYK2 PSEUDOKINASE LIGANDS TYK2, JAK2, PTK2B LMNA 2091/4885KMT2A 901/4885ATM 389/4885

“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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