SCHEMBL30462676

SCHEMBL30462676

O=C(c1ccccc1)c1ccc(CN2C=CC(c3ccc(-n4c5ccccc5c5ccccc54)cc3)=CC2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 3/20 0.38
▸ AKR1C4 P17516 1/20 0.37
▸ AKR1C3 P42330 1/20 0.37
▸ AKR1C2 P52895 1/20 0.37
▸ AKR1C1 Q04828 1/20 0.37
▸ TP53 P04637 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ STAT1 P42224 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HDAC4 P56524 1/20 0.35
▸ HDAC1 Q13547 2/20 0.35

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
SCHEMBL30462678 0.88 L3MBTL1 (0.41) PTPN1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL30462677 0.86 AKR1C4 (0.39) PTPN1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL30462681 0.84 PTPN1 (0.36) PTPN1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL31597600 0.84 PTPN1 (0.36) PTPN1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL30825163 0.76 DRD2 (0.37) TP53ALDH1A1TSHRHSD17B10L3MBTL1
SCHEMBL3331741 0.74 L3MBTL1 (0.61) PTPN1TP53ALDH1A1TSHRHSD17B10
SCHEMBL31356468 0.74 L3MBTL1 (0.61) PTPN1TP53ALDH1A1TSHRHSD17B10
SCHEMBL13781082 0.73 L3MBTL1 (0.53) PTPN1TP53ALDH1A1TSHRHSD17B10
SCHEMBL30462667 0.73 CYP19A1 (0.43) TP53ALDH1A1TSHRHSD17B10L3MBTL1
SCHEMBL27827661 0.72 SIGMAR1 (0.38) ALDH1A1L3MBTL1RAB9ALMNAMAPT

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
CN-116283737-A Pyridine salt organic photosensitizer and preparation method and application thereof 广东工业大学 2023-06-23 — — CN claimed
CN-116283737-B Pyridine salt organic photosensitizer and preparation method and application thereof 广东工业大学 2025-05-30 — — CN disclosed
CN-116283737-A Pyridine salt organic photosensitizer and preparation method and application thereof 广东工业大学 2023-06-23 — — CN disclosed
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