SCHEMBL23326428

SCHEMBL23326428

Nc1ccc(Nc2nc(Cl)nc(N3CCOCC3)n2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.68
MAPT P10636 4/20 0.61
LMNA P02545 3/20 0.61
CYP1A2 P05177 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2C9 P11712 1/20 0.61
CYP2C19 P33261 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
HTT P42858 2/20 0.60
CA12 O43570 2/20 0.58
CA1 P00915 2/20 0.58
CA2 P00918 2/20 0.58
CA9 Q16790 2/20 0.58
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
MAPK1 P28482 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
GBA1 P04062 1/20 0.56
KDM4E B2RXH2 1/20 0.55

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
SCHEMBL31086767 0.89 LMNA (0.68) PTGS2MAPTLMNACYP1A2CYP3A4
SCHEMBL1658390 0.87 MAPT (0.82) PTGS2MAPTLMNACYP1A2CYP3A4
SCHEMBL23321312 0.87 LMNA (0.82) PTGS2MAPTLMNACYP1A2CYP3A4
SCHEMBL27776226 0.86 LMNA (0.81) PTGS2MAPTLMNACYP1A2CYP3A4
SCHEMBL11876083 0.85 PTGS2 (0.62) PTGS2MAPTLMNACYP1A2CYP3A4
SCHEMBL19662022 0.85 PTGS2 (0.65) PTGS2MAPTLMNACYP1A2CYP3A4
SCHEMBL23326278 0.84 PTGS2 (0.61) PTGS2MAPTLMNACYP1A2CYP3A4
SCHEMBL23321355 0.83 PTGS2 (0.63) PTGS2MAPTLMNACYP1A2CYP3A4
SCHEMBL16344213 0.81 PTGS2 (0.72) PTGS2MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL3394840 0.81 CTSS (0.72) PTGS2MAPTLMNACYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240368184-A1 PIKfyve Inhibitors MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2024-11-07 US disclosed
US-12030896-B2 PIKfyve inhibitors MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2024-07-09 US disclosed
US-12030896-B2 PIKfyve inhibitors MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2024-07-09 US disclosed
US-12030896-B2 PIKfyve inhibitors MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2024-07-09 US disclosed
US-20210139505-A1 PIKfyve Inhibitors Sanford Burnham Prebys Medical Discovery Institute 2021-05-13 US disclosed
US-20210139505-A1 PIKfyve Inhibitors Sanford Burnham Prebys Medical Discovery Institute 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 (3 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-12030896-B2 PIKfyve inhibitors PIKFYVE, PIP4K2B, PIP4K2A PTGS2 4714/4885MAPT 3914/4885LMNA 3750/4885
US-20210139505-A1 PIKfyve Inhibitors PIKFYVE, PIP4K2B, PIP4K2A PTGS2 4714/4885MAPT 3914/4885LMNA 3750/4885
US-20240368184-A1 PIKfyve Inhibitors PIKFYVE, PIP4K2B, PIP4K2A PTGS2 4714/4885MAPT 3914/4885LMNA 3750/4885

“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.