SCHEMBL9172178

SCHEMBL9172178

O=C1C(=O)N2CCOc3cccc1c32

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.51
ALDH1A1 P00352 3/20 0.41
POLB P06746 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PKM P14618 2/20 0.38
TSHR P16473 1/20 0.38
P2RX7 Q99572 1/20 0.35
HTR1A P08908 2/20 0.35
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
NOTUM Q6P988 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
ALDH3A1 P30838 1/20 0.34
PRMT5 O14744 2/20 0.33
WDR77 Q9BQA1 2/20 0.33
ITGB2 P05107 1/20 0.33
ICAM1 P05362 1/20 0.33
ITGAL P20701 1/20 0.33

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
SCHEMBL2431768 0.90 CES1 (0.56) CES1ALDH1A1POLBMEN1KMT2A
SCHEMBL9170732 0.79 CES1 (0.36) CES1ALDH1A1PKMBCHEACHE
SCHEMBL10369233 0.71 HTR2A (0.40) CES1ALDH1A1TSHRBCHEACHE
SCHEMBL10369735 0.71 CES1 (0.39) CES1P2RX7BCHEACHENOTUM
SCHEMBL9391540 0.70 CES1 (0.81) CES1ALDH1A1POLBMEN1KMT2A
SCHEMBL8768338 0.68 CES1 (1.00) CES1ALDH1A1POLBMEN1KMT2A
SCHEMBL14437093 0.68 ITGB2 (0.46) ALDH1A1HTR1ANOTUMITGB2ICAM1
SCHEMBL9118563 0.68 APAF1 (0.33) APAF1
SCHEMBL9179029 0.67 MAOB (0.50) CYP3A4MAPTCYP19A1
SCHEMBL9178502 0.67 CYP19A1 (0.46) ALDH1A1MAPTCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0310096-B1 Novel cyclic anthranilic acid derivatives and process for their preparation KYORIN SEIYAKU KK (JP) 1995-04-19 EP disclosed
US-5281600-A Antiinflammatory agents, rheumatic diseases and immunomodulators KYORIN PHARMACEUTICAL CO., LTD. (JP) 1994-01-25 US disclosed
US-5147874-A Antiarthritic agents KYORIN PHARMACEUTICAL CO., LTD. (JP) 1992-09-15 US disclosed
EP-0147805-B1 SPIRO-LINKED PYRROLIDINE-2,5-DIONES AND PROCESS FOR THEIR PREPARATION KYORIN PHARMACEUTICAL CO., LTD. (JP) 1990-10-10 EP disclosed
US-4956372-A ANTIRHEUMATOID AND IMMUNOMODULATORS KYORIN PHARMACEUTICAL CO., LTD. (JP) 1990-09-11 US disclosed
EP-0310096-A2 Novel cyclic anthranilic acid derivatives and process for their preparation KYORIN PHARMACEUTICAL CO., LTD. (JP) 1989-04-05 EP disclosed
US-4593092-A Spiro-linked pyrrolidin-2,5-dione KYORIN PHARMACEUTICAL CO., LTD. (JP) 1986-06-03 US disclosed
EP-0147805-A2 Spiro-linked pyrrolidine-2,5-diones and process for their preparation KYORIN PHARMACEUTICAL CO., LTD. (JP) 1985-07-10 EP disclosed