SCHEMBL11155682

SCHEMBL11155682

C=CCNc1ccccc1C(=O)OCC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.57
LMNA P02545 5/20 0.57
ALDH1A1 P00352 6/20 0.56
KDM4E B2RXH2 8/20 0.55
HSD17B10 Q99714 4/20 0.55
CDC25B P30305 2/20 0.53
CDC25A P30304 1/20 0.53
CDC25C P30307 1/20 0.53
KMT2A Q03164 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2C19 P33261 1/20 0.53
CASP3 P42574 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
NPSR1 Q6W5P4 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
TP53 P04637 1/20 0.52
HTT P42858 1/20 0.52
ADRA1D P25100 1/20 0.52

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
SCHEMBL11387390 0.87 TSHR (0.49) TSHRLMNAALDH1A1KDM4EHSD17B10
SCHEMBL27901950 0.87 CYP3A4 (0.68) TSHRLMNAALDH1A1KDM4EHSD17B10
SCHEMBL11062628 0.86 KDM4E (0.62) TSHRLMNAALDH1A1KDM4EHSD17B10
SCHEMBL1460556 0.83 TSHR (0.67) TSHRLMNAALDH1A1KDM4EHSD17B10
Hydrochloric Acid SCHEMBL6383958 0.81 TSHR (0.65) TSHRLMNAALDH1A1KDM4EHSD17B10
SCHEMBL2510669 0.81 MAPT (0.48) LMNAALDH1A1KDM4EHSD17B10KMT2A
SCHEMBL9592036 0.81 TP53 (0.47) TSHRLMNAALDH1A1KDM4EHSD17B10
SCHEMBL11071275 0.80 ALDH1A1 (0.43) TSHRLMNAALDH1A1KDM4EKMT2A
SCHEMBL5180569 0.80 GAA (0.48) LMNAALDH1A1KDM4EHSD17B10CYP1A2
SCHEMBL11159593 0.80 TSHR (0.62) TSHRLMNAALDH1A1KDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0018139-B1 PYRIDO (2,3-D) PYRIMIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR PREPARING THE PYRIDO (2,3-D) PYRIMIDINE DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION (US) 1983-05-04 EP disclosed
US-4301281-A 7,8-Dihydro-2,5,8-trisubstituted-7-oxo-pyrido[2,3-d]-pyrimidine-6-carboxylic acid amides AMERICAN HOME PRODUCTS CORPORATION (US) 1981-11-17 US disclosed
US-4255568-A ANTIALLERGENS AND ANTISECRETORY AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1981-03-10 US disclosed
US-4236004-A 2-Alkylsulphonyl-7,8-dihydro-5-hydroxy-7-oxo-pyrido[2,3-d]pyrimidine-6-carboxylic acid derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1980-11-25 US disclosed
US-4233446-A 5-Chloro-7,8-dihydro-7-oxo-pyrido[2,3-d]pyrimidine-6-carboxylic acid derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1980-11-11 US disclosed
EP-0018139-A2 Pyrido (2,3-d) pyrimidine derivatives, pharmaceutical compositions containing them and processes for preparing the pyrido (2,3-d) pyrimidine derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1980-10-29 EP disclosed
US-4215216-A 7,8-Dihydro-2,5,8-trisubstituted-7-oxo-pyrido[2,3-d]pyrimidine-6-carboxylic acid derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1980-07-29 US disclosed