SCHEMBL6754817

SCHEMBL6754817

N#CC(=Cc1c[nH]c2ccncc12)C(N)=S

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF20A O95235 2/20 0.46
▸ ALDH1A1 P00352 9/20 0.44
▸ MAPT P10636 8/20 0.44
▸ POLB P06746 4/20 0.43
▸ APP P05067 1/20 0.42
▸ PIP4K2A P48426 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ GAA P10253 3/20 0.40
▸ HTT P42858 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ KDM4E B2RXH2 5/20 0.39
▸ TDP1 Q9NUW8 5/20 0.39
▸ LMNA P02545 2/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ DYRK1A Q13627 2/20 0.39
▸ MEN1 O00255 5/20 0.39
▸ KMT2A Q03164 5/20 0.39
▸ RECQL P46063 4/20 0.39
▸ HPGD P15428 3/20 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
SCHEMBL6754816 1.00 KIF20A (0.46) KIF20AALDH1A1MAPTPOLBAPP
SCHEMBL6755586 0.90 KIF20A (0.46) KIF20AALDH1A1MAPTPOLBAPP
SCHEMBL6755585 0.90 KIF20A (0.46) KIF20AALDH1A1MAPTPOLBAPP
SCHEMBL6755629 0.87 KDM4E (0.52) KIF20AALDH1A1MAPTPOLBAPP
SCHEMBL6755627 0.87 KDM4E (0.52) KIF20AALDH1A1MAPTPOLBAPP
SCHEMBL6755476 0.81 APP (0.63) KIF20AALDH1A1MAPTPOLBAPP
SCHEMBL6755562 0.77 KDM4E (0.52) KIF20AALDH1A1MAPTPOLBAPP
SCHEMBL6755563 0.77 KDM4E (0.52) KIF20AALDH1A1MAPTPOLBAPP
SCHEMBL6755673 0.77 CHEK1 (0.58) KIF20AALDH1A1MAPTPOLBNPC1
SCHEMBL6755674 0.77 CHEK1 (0.58) KIF20AALDH1A1MAPTPOLBNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3507497-B2 — — 2004-03-15 — — JP claimed
EP-0626963-B1 VINYLENE-AZAINDOLE DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN SPA (IT) 1999-06-09 — — EP claimed
EP-0626963-A1 VINYLENE-AZAINDOLE DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN S.p.A. (IT) 1994-12-07 — — EP claimed
WO-1994014808-A1 VINYLENE-AZAINDOLE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA SRL (IT) 1994-07-07 — — WO claimed
EP-0626963-B1 VINYLENE-AZAINDOLE DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN SPA (IT) 1999-06-09 — — EP disclosed
US-5397787-A Tyrosine kinase inhibitors FARMITALIA CARLO ERBA S.R.L. (IT) 1995-03-14 — — US disclosed
EP-0626963-A1 VINYLENE-AZAINDOLE DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN S.p.A. (IT) 1994-12-07 — — EP disclosed
WO-1994014808-A1 VINYLENE-AZAINDOLE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA SRL (IT) 1994-07-07 — — WO disclosed
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