SCHEMBL20184672

SCHEMBL20184672

CCc1nc(-c2ccc3ccccc3c2)c2c(C(=O)O)c[nH]c2n1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 6/20 0.54
JAK3 P52333 6/20 0.54
ACMSD Q8TDX5 1/20 0.41
CA12 O43570 1/20 0.41
RAB9A P51151 2/20 0.39
DHODH Q02127 1/20 0.39
CTRC Q99895 1/20 0.39
SGK1 O00141 4/20 0.39
CAMKK2 Q96RR4 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALPL P05186 1/20 0.38

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
SCHEMBL20184489 0.88 JAK2 (0.51) JAK2JAK3DHODHSGK1CAMKK2
SCHEMBL20184525 0.88 JAK2 (0.49) JAK2JAK3SGK1CAMKK2
SCHEMBL20184551 0.84 JAK3 (0.53) JAK2JAK3DHODH
SCHEMBL20184548 0.84 JAK3 (0.53) JAK2JAK3DHODHSGK1CAMKK2
SCHEMBL20184518 0.84 PRKAB2 (0.48) JAK2JAK3DHODHKMT2A
SCHEMBL20184527 0.83 JAK2 (0.49) JAK2JAK3DHODHSGK1CAMKK2
SCHEMBL20184337 0.83 JAK2 (0.43) JAK2JAK3RAB9A
SCHEMBL20184581 0.83 JAK3 (0.43) JAK2JAK3
SCHEMBL20184478 0.83 JAK2 (0.53) JAK2JAK3RAB9ADHODH
SCHEMBL20184673 0.83 JAK2 (0.53) JAK2JAK3RAB9AMEN1KMT2A

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-2788000-B1 PYRROLOPYRIMIDINES AS JANUS KINASE INHIBITORS MERCK SHARP & DOHME (US) 2018-05-30 EP claimed