SCHEMBL30608121

SCHEMBL30608121

Cc1cccc(-n2c(=O)c(C#N)c(N)c3ccc(Cl)cc32)c1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.53
▸ KDM4E B2RXH2 5/20 0.52
▸ NPSR1 Q6W5P4 2/20 0.52
▸ MAT2A P31153 6/20 0.51
▸ HPGD P15428 4/20 0.42
▸ RXFP1 Q9HBX9 2/20 0.42
▸ LMNA P02545 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39

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
SCHEMBL26126788 1.00 ALDH1A1 (0.53) ALDH1A1KDM4ENPSR1MAT2AHPGD
SCHEMBL30608069 0.87 MAPK8 (0.49) ALDH1A1KDM4ENPSR1MAT2AHPGD
SCHEMBL26125920 0.87 MAPK8 (0.49) ALDH1A1KDM4ENPSR1MAT2AHPGD
SCHEMBL13384795 0.83 KDM4E (0.46) ALDH1A1KDM4ENPSR1MAT2AHPGD
SCHEMBL30608067 0.82 HPGD (0.54) ALDH1A1KDM4ENPSR1MAT2AHPGD
SCHEMBL26125404 0.82 HPGD (0.54) ALDH1A1KDM4ENPSR1MAT2AHPGD
SCHEMBL30549013 0.81 MAT2A (0.57) ALDH1A1MAT2ACYP1A2
SCHEMBL29091374 0.81 MAT2A (0.57) ALDH1A1MAT2ACYP1A2
SCHEMBL24123109 0.78 MAT2A (0.43) ALDH1A1KDM4ENPSR1MAT2ARXFP1
SCHEMBL13384742 0.77 MAT2A (0.40) ALDH1A1KDM4ENPSR1MAT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250221979-A1 NOVEL HETEROCYCLIC COMPOUND SHOUYAO HOLDINGS BEIJING CO LTD (CN) 2025-07-10 — — US disclosed
CN-118475560-A Novel heterocyclic compound 首药控股(北京)股份有限公司 2024-08-09 — — CN disclosed
CN-116924983-A Novel heterocyclic compound 首药控股(北京)股份有限公司 2023-10-24 — — CN 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-20250221979-A1 NOVEL HETEROCYCLIC COMPOUND MAPT, MNAT1, MAT2A ALDH1A1 996/4885KDM4E 3698/4885NPSR1 1946/4885

“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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