Sugi Predict

Sugi Predict / Compounds / SCHEMBL6407987

SCHEMBL6407987

SCHEMBL6407987

CNS(=O)(=O)c1ccc2c(c1)/C(=C\c1[nH]c3ccccc3c1CCCN(C)C)C(=O)N2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 18/20 1.00
▸ LCK P06239 6/20 0.69
▸ FYN P06241 6/20 0.69
▸ YES1 P07947 6/20 0.69
▸ PDGFRB P09619 6/20 0.69
▸ FGFR1 P11362 6/20 0.69
▸ KDR P35968 6/20 0.69
▸ AURKA O14965 2/20 0.53
▸ AURKB Q96GD4 2/20 0.53

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
SCHEMBL6407991 1.00 SRC (1.00) SRCLCKFYNYES1PDGFRB
SCHEMBL6391553 0.84 SRC (0.71) SRCLCKFYNYES1PDGFRB
SCHEMBL6405597 0.84 SRC (0.71) SRCLCKFYNYES1PDGFRB
SCHEMBL6406219 0.82 SRC (0.70) SRCLCKFYNYES1PDGFRB
SCHEMBL6407193 0.82 SRC (0.70) SRCLCKFYNYES1PDGFRB
SCHEMBL6394677 0.82 SRC (0.80) SRCLCKFYNYES1PDGFRB
SCHEMBL6394684 0.82 SRC (0.80) SRCLCKFYNYES1PDGFRB
SCHEMBL5576995 0.82 SRC (1.00) SRCLCKFYNYES1PDGFRB
SCHEMBL5576992 0.82 SRC (1.00) SRCLCKFYNYES1PDGFRB
SCHEMBL6613083 0.82 SRC (1.00) SRCLCKFYNYES1PDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6855730-B2 3-methylidenyl-2-indolinone modulators of protein kinase SUGEN, INC. (US) 2005-02-15 — — US disclosed
US-6531502-B1 Antitumor SUGEN, INC. 2003-03-11 — — US disclosed