SCHEMBL10818337

SCHEMBL10818337

CCCCCc1nnc(Cl)nc1CCCCC

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KCNH2 Q12809 1/20 0.35
▸ ALDH1A1 P00352 3/20 0.32
▸ L3MBTL1 Q9Y468 3/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ DHFR P00374 1/20 0.32
▸ GPR84 Q9NQS5 1/20 0.32
▸ TYMP P19971 2/20 0.31
▸ LMNA P02545 1/20 0.30

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
SCHEMBL12539378 0.77 KMT2A (0.43) KMT2AMEN1KCNH2ALDH1A1L3MBTL1
SCHEMBL4949768 0.77 GPR84 (0.47) KMT2AMEN1KCNH2ALDH1A1L3MBTL1
SCHEMBL10816526 0.76 MEN1 (0.35) KMT2AMEN1KCNH2ALDH1A1TDP1
SCHEMBL12539352 0.75 KMT2A (0.42) KMT2AMEN1KCNH2ALDH1A1PKM
SCHEMBL10815973 0.75 MEN1 (0.37) KMT2AMEN1KCNH2ALDH1A1GPR84
SCHEMBL8040945 0.75 KMT2A (0.42) KMT2AMEN1KCNH2ALDH1A1L3MBTL1
SCHEMBL10816555 0.75 MEN1 (0.37) KMT2AMEN1KCNH2ALDH1A1L3MBTL1
SCHEMBL3662375 0.75 DHFR (0.45) KMT2AMEN1KCNH2ALDH1A1L3MBTL1
SCHEMBL1685611 0.73 KMT2A (0.41) KMT2AMEN1KCNH2ALDH1A1L3MBTL1
SCHEMBL3265562 0.72 MEN1 (0.39) KMT2AMEN1KCNH2ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0088593-B1 1,2,4-TRIAZINE AND PYRAZINE DERIVATIVES ELI LILLY AND COMPANY (US) 1987-05-27 — — EP disclosed
EP-0088593-A2 1,2,4-Triazine and pyrazine derivatives ELI LILLY AND COMPANY (US) 1983-09-14 — — EP disclosed
US-4318911-A 5,6-Diaryl-1,2,4-triazines as topical antithrombotic agents ELI LILLY AND COMPANY (US) 1982-03-09 — — US disclosed
US-4310551-A Pharmacologically active substituted 1,2,4-triazines DIAMOND SHAMROCK CORPORATION (US) 1982-01-12 — — US disclosed
US-4251527-A ANTIINFLAMMATORY AGENTS DIAMOND SHAMROCK CORPORATION (US) 1981-02-17 — — US disclosed
US-4190725-A ANTIINFLAMMATORY ELI LILLY AND COMPANY (US) 1980-02-26 — — US disclosed
US-4157392-A HYPOTENSIVE AGENTS, ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIPYRETICS AND NERVOUS SYSTEM EFFECTS DIAMOND SHAMROCK CORPORATION (US) 1979-06-05 — — US disclosed
US-4021553-A 5,6-Diaryl-1,2,4-triazines as topically-active anti-inflammatory agents ELI LILLY AND COMPANY (US) 1977-05-03 — — US disclosed
US-4018923-A 5,6-Diaryl-1,2,4-triazines as topically-active anti-inflammatory agents ELI LILLY AND COMPANY (US) 1977-04-19 — — US disclosed
US-4013654-A ANTIINFLAMMATORY ELI LILLY AND COMPANY (US) 1977-03-22 — — US disclosed
US-3989831-A Topically-active anti-inflammatory 3-chloro-5,6-diaryl-1,2,4-triazines ELI LILLY AND COMPANY (US) 1976-11-02 — — US disclosed
US-3989831-A Topically-active anti-inflammatory 3-chloro-5,6-diaryl-1,2,4-triazines ELI LILLY AND COMPANY (US) 1976-11-02 — — US disclosed
US-3989831-A Topically-active anti-inflammatory 3-chloro-5,6-diaryl-1,2,4-triazines ELI LILLY AND COMPANY (US) 1976-11-02 — — US disclosed
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