SCHEMBL7988904

SCHEMBL7988904

CCCCNc1ccc(-c2nc(C(=O)Nc3nccs3)c(-c3ccc(Cl)cc3)[nH]2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.50
KMT2A Q03164 6/20 0.50
MAPT P10636 5/20 0.50
ALDH1A1 P00352 2/20 0.50
ADORA2A P29274 4/20 0.44
CYP2C9 P11712 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CASP3 P42574 1/20 0.43
HTT P42858 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
GAA P10253 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
KDM4E B2RXH2 2/20 0.43
MGAM O43451 1/20 0.43

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
SCHEMBL7988807 0.92 ADORA2A (0.45) MEN1KMT2AMAPTALDH1A1ADORA2A
SCHEMBL7988512 0.91 MEN1 (0.45) MEN1KMT2AMAPTALDH1A1ADORA2A
SCHEMBL7992126 0.90 NPC1 (0.46) MEN1KMT2AMAPTALDH1A1ADORA2A
SCHEMBL7989590 0.90 MAPT (0.53) MEN1KMT2AMAPTALDH1A1ADORA2A
Hydrochloric Acid SCHEMBL7977698 0.89 MAPT (0.53) MEN1KMT2AMAPTALDH1A1ADORA2A
SCHEMBL7991889 0.86 MEN1 (0.53) MEN1KMT2AMAPTALDH1A1CYP2C9
SCHEMBL7977611 0.85 MAPK1 (0.49) MEN1KMT2AMAPTALDH1A1ADORA2A
SCHEMBL7992215 0.84 MAPT (0.55) MEN1KMT2AMAPTALDH1A1ADORA2A
Hydrochloric Acid SCHEMBL7988824 0.83 MAPT (0.54) MEN1KMT2AMAPTALDH1A1ADORA2A
SCHEMBL7978123 0.83 RAB9A (0.41) MEN1KMT2AMAPTALDH1A1ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US claimed
US-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US disclosed