SCHEMBL11619008

SCHEMBL11619008

Cc1cc2c3c(N)nc(N)nc3ccc2n1Cc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 9/20 0.61
▸ DHFR P00374 8/20 0.61
▸ F2R P25116 2/20 0.50

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
SCHEMBL29232592 0.93 SLC2A1 (0.64) SLC2A1DHFRF2R
SCHEMBL11617981 0.86 SLC2A1 (0.62) SLC2A1DHFRF2R
SCHEMBL24166658 0.85 DHFR (0.55) SLC2A1DHFRF2R
SCHEMBL25074353 0.85 DHFR (0.65) SLC2A1DHFRF2R
SCHEMBL30252143 0.85 DHFR (0.65) SLC2A1DHFRF2R
SCHEMBL29232537 0.82 DHFR (0.54) SLC2A1DHFR
SCHEMBL11614277 0.76 SLC2A1 (1.00) SLC2A1DHFRF2R
SCHEMBL29232451 0.76 DHFR (0.49) SLC2A1DHFR
SCHEMBL9568517 0.74 DHFR (1.00) SLC2A1DHFR
SCHEMBL9543453 0.73 DHFR (1.00) SLC2A1DHFR

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
US-4118561-A ANTIBACTERIAL, SYNERGISTIC, ANTI-CANCER ACTIVITY, ANTI-FOLIC ACID ACTIVITY AMERICAN HOME PRODUCTS CORPORATION (US) 1978-10-03 — — US disclosed
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