SCHEMBL30705668

SCHEMBL30705668

NC(=O)[C@@H](N)Cc1cc2cnccc2[nH]c1=O

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.52
TSHR P16473 2/20 0.41
HSD17B10 Q99714 7/20 0.41
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
KDM4E B2RXH2 8/20 0.39
ALDH1A1 P00352 5/20 0.39
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
NAMPT P43490 2/20 0.38
CYP2C9 P11712 1/20 0.38
HRH4 Q9H3N8 1/20 0.38
HPGD P15428 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPK1 P28482 1/20 0.37
GAA P10253 1/20 0.36
F2 P00734 1/20 0.36
F3 P13726 1/20 0.36

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
SCHEMBL30705613 1.00 DAO (0.52) DAOTSHRHSD17B10PDE3BPDE3A
SCHEMBL30705453 0.78 KDM4E (0.57) DAOTSHRHSD17B10KDM4EALDH1A1
SCHEMBL30705488 0.78 KDM4E (0.57) DAOTSHRHSD17B10KDM4EALDH1A1
Hydrochloric Acid SCHEMBL30705464 0.77 KDM4E (0.56) DAOTSHRHSD17B10KDM4EALDH1A1
Hydrochloric Acid SCHEMBL31475445 0.77 KDM4E (0.56) DAOTSHRHSD17B10KDM4EALDH1A1
SCHEMBL24312093 0.76 DAO (0.61) DAOTSHRHSD17B10PDE3BPDE3A
SCHEMBL30705593 0.75 KDM4E (0.55) TSHRHSD17B10KDM4EALDH1A1LMNA
Hydrochloric Acid SCHEMBL31475464 0.74 DAO (0.50) DAOTSHRHSD17B10KDM4EALDH1A1
Hydrochloric Acid SCHEMBL32662539 0.74 KDM4E (0.55) DAOTSHRHSD17B10KDM4EALDH1A1
Hydrochloric Acid SCHEMBL30705452 0.74 TSHR (0.36) TSHRHSD17B10KDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4539844-A2 COMPOUNDS FOR TREATMENT OF A CORONAVIRUS INFECTION Trawsfynydd Therapeutics, Inc. (US) 2025-04-23 EP disclosed
CN-119604290-A Compounds for the treatment of coronavirus infections 特劳斯芬尼德治疗股份有限公司 2025-03-11 CN disclosed
WO-2023245166-A2 COMPOUNDS FOR TREATMENT OF A CORONAVIRUS INFECTION TRAWSFYNYDD THERAPEUTICS, INC. (US) 2023-12-21 WO disclosed