SCHEMBL17500359

SCHEMBL17500359

Nc1nc2c(c(=O)[nH]1)N(C=O)[C@H](CNc1ccc(C(=O)O)cc1)CN2

nearest known ligand 0.72

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DHFR P00374 1/20 0.72
▸ LMNA P02545 1/20 0.68
▸ MTHFD1 P11586 2/20 0.49
▸ SOST Q9BQB4 1/20 0.44
▸ FPGS Q05932 3/20 0.44
▸ NOS1 P29475 4/20 0.42
▸ MTHFD2 P13995 2/20 0.40
▸ TYMS P04818 2/20 0.37
▸ NOS3 P29474 1/20 0.36
▸ NOS2 P35228 1/20 0.36

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
SCHEMBL3408027 1.00 DHFR (0.72) DHFRLMNAMTHFD1SOSTFPGS
SCHEMBL17500357 1.00 DHFR (0.72) DHFRLMNAMTHFD1SOSTFPGS
SCHEMBL18020455 0.87 DHFR (0.63) DHFRLMNAMTHFD1SOSTFPGS
SCHEMBL20910478 0.86 DHFR (0.74) DHFRLMNAMTHFD1SOSTFPGS
SCHEMBL24179695 0.86 DHFR (0.74) DHFRLMNAMTHFD1SOSTFPGS
SCHEMBL17500358 0.85 DHFR (0.57) DHFRLMNAMTHFD1SOSTFPGS
SCHEMBL17500356 0.85 DHFR (0.57) DHFRLMNAMTHFD1SOSTFPGS
SCHEMBL18402509 0.84 DHFR (0.83) DHFRLMNAMTHFD1SOSTFPGS
Folinic Acid SCHEMBL21498299 0.84 DHFR (1.00) DHFRLMNAMTHFD1SOSTFPGS
Leucovorin SCHEMBL3031362 0.84 DHFR (1.00) DHFRLMNAMTHFD1SOSTFPGS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180237781-A1 COMPOSITIONS AND METHODS FOR REGULATION OF GENE EXPRESSION WITH, AND DETECTION OF, FOLINIC ACID AND FOLATES THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2018-08-23 — — US claimed
WO-2016025750-A2 COMPOSITIONS AND METHODS FOR REGULATION OF GENE EXPRESSION WITH, AND DETECTION OF, FOLINIC ACID AND FOLATES THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2016-02-18 — — WO claimed
US-20200255835-A1 COMPOSITIONS AND METHODS FOR REGULATION OF GENE EXPRESSION WITH, AND DETECTION OF, FOLINIC ACID AND FOLATES THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2020-08-13 — — US disclosed
US-10450573-B2 Compositions and methods for regulation of gene expression with, and detection of, folinic acid and folates THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2019-10-22 — — US disclosed
US-20180237781-A1 COMPOSITIONS AND METHODS FOR REGULATION OF GENE EXPRESSION WITH, AND DETECTION OF, FOLINIC ACID AND FOLATES THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2018-08-23 — — US disclosed
WO-2016025750-A2 COMPOSITIONS AND METHODS FOR REGULATION OF GENE EXPRESSION WITH, AND DETECTION OF, FOLINIC ACID AND FOLATES THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2016-02-18 — — WO disclosed
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