SCHEMBL22913664

SCHEMBL22913664

O=C(CN1CN(c2ccccc2)C2(CCN(C(=O)c3ccc4[nH]ncc4c3)CC2)C1=O)NC1CC1

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DDR1 Q08345 20/20 0.81
DDR2 Q16832 1/20 0.76

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
SCHEMBL20187065 0.90 DDR1 (1.00) DDR1DDR2
SCHEMBL18373966 0.89 DDR1 (1.00) DDR1DDR2
SCHEMBL18373958 0.89 DDR1 (1.00) DDR1DDR2
SCHEMBL20187176 0.89 DDR1 (1.00) DDR1DDR2
SCHEMBL20187073 0.89 DDR1 (0.83) DDR1DDR2
SCHEMBL22912899 0.87 DDR1 (0.81) DDR1DDR2
SCHEMBL18374188 0.87 DDR1 (1.00) DDR1DDR2
SCHEMBL22914249 0.87 DDR1 (1.00) DDR1DDR2
SCHEMBL18374184 0.87 DDR1 (1.00) DDR1DDR2
SCHEMBL20187175 0.87 DDR1 (1.00) DDR1DDR2

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
EP-3317279-B1 TRIAZA-SPIRODECANONES AS DDR1 INHIBITORS HOFFMANN LA ROCHE (CH) 2021-01-27 EP disclosed