SCHEMBL31199213

SCHEMBL31199213

CC(C)n1nc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)c2ccccc2c1=O

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.55
▸ LMNA P02545 5/20 0.55
▸ GAA P10253 2/20 0.55
▸ NPSR1 Q6W5P4 2/20 0.51
▸ KMT2A Q03164 3/20 0.50
▸ USP2 O75604 1/20 0.50
▸ GRM5 P41594 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ FAAH O00519 1/20 0.45
▸ MGLL Q99685 1/20 0.45
▸ MAPT P10636 5/20 0.44
▸ HTT P42858 3/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ ATM Q13315 1/20 0.43
▸ HSP90AA1 P07900 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ MAPK1 P28482 1/20 0.42

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
SCHEMBL30976302 0.89 LMNA (0.52) ALDH1A1LMNAGAANPSR1KMT2A
SCHEMBL30976384 0.86 MEN1 (0.53) ALDH1A1LMNAGAANPSR1KMT2A
SCHEMBL30976303 0.84 ALDH1A1 (0.56) ALDH1A1LMNAGAANPSR1KMT2A
SCHEMBL31199145 0.84 ALDH1A1 (0.55) ALDH1A1LMNAGAANPSR1KMT2A
SCHEMBL30976246 0.82 NPSR1 (0.76) ALDH1A1LMNAGAANPSR1KMT2A
SCHEMBL30976308 0.82 ALDH1A1 (0.59) ALDH1A1LMNAGAANPSR1KMT2A
SCHEMBL31199155 0.78 ALDH1A1 (0.56) ALDH1A1LMNAGAANPSR1KMT2A
SCHEMBL30976420 0.78 ALDH1A1 (0.56) ALDH1A1LMNAGAANPSR1KMT2A
SCHEMBL30976326 0.78 ALDH1A1 (0.57) ALDH1A1LMNAGAANPSR1KMT2A
SCHEMBL31199102 0.76 ALDH1A1 (0.55) ALDH1A1LMNAGAANPSR1KMT2A

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-12465603-B2 Phthalazinone based modulators for the treatment of disease SOLEY THERAPEUTICS, INC. (US) 2025-11-11 — — US disclosed
US-20240374589-A1 PHTHALAZINONE BASED MODULATORS FOR THE TREATMENT OF DISEASE SOLEY THERAPEUTICS, INC. 2024-11-14 — — 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-12465603-B2 Phthalazinone based modulators for the treatment of disease MKI67, BCL2, CCAR2 ALDH1A1 2021/4885LMNA 2935/4885GAA 432/4885
US-20240374589-A1 PHTHALAZINONE BASED MODULATORS FOR THE TREATMENT OF DISEASE MKI67, HDAC6, BCL2 ALDH1A1 1827/4885LMNA 3199/4885GAA 350/4885

“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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