SCHEMBL31361350

SCHEMBL31361350

Cc1[nH]c2c(N3CCCCC3)c(-c3ccccc3)nn2c(=O)c1Cc1ccncc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAT2A P31153 6/20 0.42
▸ KIF11 P52732 1/20 0.37
▸ ALDH1A1 P00352 5/20 0.36
▸ NPSR1 Q6W5P4 4/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ LMNA P02545 3/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ MAPT P10636 3/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ GLA P06280 1/20 0.36
▸ KDM4E B2RXH2 3/20 0.35
▸ ALKBH3 Q96Q83 2/20 0.35
▸ NR3C1 P04150 1/20 0.34
▸ HTT P42858 3/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ AGTR1 P30556 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ POLB P06746 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
SCHEMBL31361328 0.90 MAT2A (0.42) MAT2AKIF11ALDH1A1NPSR1MEN1
SCHEMBL31361411 0.90 MAT2A (0.52) MAT2AKIF11ALDH1A1NPSR1MEN1
SCHEMBL31361266 0.88 MEN1 (0.48) MAT2AALDH1A1NPSR1MEN1LMNA
SCHEMBL31361448 0.86 P2RX3 (0.39) MAT2AALDH1A1NPSR1MEN1LMNA
SCHEMBL31361403 0.85 MAT2A (0.39) MAT2AKIF11NPSR1MEN1KMT2A
SCHEMBL31361299 0.84 MAT2A (0.41) MAT2AALDH1A1NPSR1MEN1LMNA
SCHEMBL31361346 0.84 MEN1 (0.39) MAT2AKIF11ALDH1A1NPSR1MEN1
SCHEMBL19972068 0.84 MAT2A (0.52) MAT2AALDH1A1MEN1LMNAKMT2A
SCHEMBL31361416 0.84 TUBB4A (0.41) MAT2ANPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL31361364 0.84 KMT2A (0.40) MAT2AALDH1A1NPSR1MEN1LMNA

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
CN-113999232-B MAT2A inhibitors 南京正大天晴制药有限公司 2025-01-07 — — CN disclosed
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