SCHEMBL30705391

SCHEMBL30705391

FC(F)Oc1cccc(NN2C=CC=CC2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 1/20 0.40
KCNJ5 P48544 1/20 0.40
KCNJ3 P48549 1/20 0.40
GALR2 O43603 2/20 0.40
GALR1 P47211 1/20 0.40
GRM4 Q14833 3/20 0.40
EPHX2 P34913 1/20 0.39
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
LMNA P02545 3/20 0.38
MAPT P10636 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
RAB9A P51151 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
EP300 Q09472 1/20 0.35
CREBBP Q92793 1/20 0.35
TOP2A P11388 1/20 0.34
HTT P42858 2/20 0.34

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
SCHEMBL30705387 0.82 KMT2A (0.42) KMT2AMEN1LMNAMAPTRAB9A
SCHEMBL3681186 0.72 TDP1 (0.37) LMNAALDH1A1
SCHEMBL14233363 0.68 TAS2R14 (0.51) TAS2R14KCNJ5KCNJ3GALR2GALR1
SCHEMBL22838167 0.68 TAS2R14 (0.51) TAS2R14KCNJ5KCNJ3GALR2GALR1
SCHEMBL18884385 0.68 TAS2R14 (0.51) TAS2R14KCNJ5KCNJ3GALR2GALR1
SCHEMBL21258954 0.66 TAS2R14 (0.66) TAS2R14KCNJ5KCNJ3GALR2GALR1
Hydrochloric Acid SCHEMBL14150624 0.66 TAS2R14 (0.50) TAS2R14KCNJ5KCNJ3GALR2GALR1
SCHEMBL4106286 0.65 MAPT (0.65) TAS2R14KCNJ5KCNJ3GRM4EPHX2
SCHEMBL18154972 0.64 TAS2R14 (0.48) TAS2R14KCNJ5KCNJ3GALR2GALR1
SCHEMBL15755676 0.64 GRM4 (0.49) TAS2R14KCNJ5KCNJ3GALR2GALR1

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
CN-117098765-A Heterocyclic derivatives as Janus kinase inhibitors 奇斯药制品公司 2023-11-21 CN disclosed