SCHEMBL18166597

SCHEMBL18166597

CCOC(=O)Cc1csc(NC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 2/20 1.00
▸ MAPT P10636 2/20 0.61
▸ SMN1; SMN2 Q16637 3/20 0.59
▸ LMNA P02545 1/20 0.59
▸ TP53 P04637 1/20 0.58
▸ TSHR P16473 2/20 0.57
▸ KDM4E B2RXH2 1/20 0.56
▸ ATM Q13315 1/20 0.56
▸ GAA P10253 2/20 0.55
▸ CYP1A2 P05177 1/20 0.54
▸ ALOX15 P16050 1/20 0.54

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
SCHEMBL18166643 0.84 RXFP1 (0.72) RXFP1MAPTSMN1; SMN2LMNATP53
SCHEMBL18166677 0.83 RXFP1 (0.70) RXFP1MAPTSMN1; SMN2LMNAKDM4E
SCHEMBL18166592 0.79 MAPT (0.74) RXFP1MAPTSMN1; SMN2LMNATP53
SCHEMBL18166652 0.79 RXFP1 (0.65) RXFP1MAPTTP53TSHRKDM4E
SCHEMBL10114670 0.78 MAPT (0.82) RXFP1MAPTSMN1; SMN2LMNAKDM4E
SCHEMBL27793543 0.78 MAPT (0.79) RXFP1MAPTSMN1; SMN2LMNATSHR
SCHEMBL16440384 0.78 MAPT (0.73) RXFP1MAPTSMN1; SMN2LMNATP53
SCHEMBL18166729 0.78 RXFP1 (0.64) RXFP1MAPTTP53TSHRKDM4E
SCHEMBL12260494 0.78 SMN1; SMN2 (0.76) RXFP1MAPTSMN1; SMN2LMNATP53
SCHEMBL18166709 0.78 SMN1; SMN2 (0.73) RXFP1MAPTSMN1; SMN2LMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3663295-A1 2,6-DIOXO,-2,3-DIHYDRO-1H-PURINE COMPOUNDS USEFUL FOR TREATING DISORDERS RELATED TO THE ACTIVITY OF THE TRPA1 CHANNEL ELI LILLY AND CO. (US) 2020-06-10 — — EP disclosed
EP-3184527-A1 2,6-DIOXO,-2,3-DIHYDRO-1H-PURINE COMPOUNDS USEFUL FOR TREATING DISORDERS RELATED TO THE ACTIVITY OF THE TRPA1 CHANNEL Hydra Biosciences, Inc. (US) 2017-06-28 — — EP disclosed
EP-2170309-B1 2,6-DIOXO,-2,3-DIHYDRO-1H-PURINE COMPOUNDS USEFUL FOR TREATING DISORDERS RELATED TO THE ACTIVITY OF THE TRPA1 CHANNEL HYDRA BIOSCIENCES INC (US) 2016-10-26 — — EP disclosed
CN-101801362-B Methods and compositions for treating disorders HYDRA BIOSCIENCES INC 2014-01-22 — — CN disclosed
CN-101801362-A methods and compositions for treating disorders HYDRA BIOSCIENCES INC 2010-08-11 — — CN disclosed
Send feedback