SCHEMBL5583635

SCHEMBL5583635

COc1ccnc(C(=O)O)c1OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
MRGPRX4 Q96LA9 1/20 0.47
PDE4D Q08499 1/20 0.46
HTR1A P08908 1/20 0.46
ADRA1D P25100 1/20 0.46
ADRA1A P35348 1/20 0.46
ADRA1B P35368 1/20 0.46
BCHE P06276 1/20 0.46
HPGD P15428 2/20 0.46
LMNA P02545 1/20 0.46
ATM Q13315 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PTGER4 P35408 1/20 0.45
PTGER3 P43115 1/20 0.45
PTGER2 P43116 1/20 0.45
SRD5A1 P18405 1/20 0.44

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
SCHEMBL14458099 0.90 KCNA3 (0.48) RXRAMEN1KMT2APDE4DHTR1A
SCHEMBL4890014 0.90 KDM4E (0.47) RXRAMEN1KMT2AHPGDKDM4E
SCHEMBL5583641 0.89 LMNA (0.53) RXRAMEN1KMT2APDE4DHTR1A
SCHEMBL4681700 0.89 RXRA (0.50) RXRAMRGPRX4HTR1AADRA1DADRA1A
SCHEMBL4152950 0.88 RAB9A (0.50) RXRAMRGPRX4HTR1AADRA1DADRA1A
SCHEMBL2264912 0.87 SMN1; SMN2 (0.47) MEN1KMT2APDE4DHTR1AADRA1D
SCHEMBL8881471 0.84 MRGPRX4 (0.49) RXRAMRGPRX4HTR1AADRA1DADRA1A
SCHEMBL10530981 0.83 RAB9A (0.54) RXRAMEN1KMT2AMRGPRX4LMNA
SCHEMBL30440105 0.83 ALDH1A1 (0.48) MEN1KMT2ALMNANPC1SMN1; SMN2
SCHEMBL29248937 0.82 PTPN1 (0.48) RXRAMEN1KMT2AHPGDLMNA

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
US-7183278-B1 Picolinamide derivative and harmful organism control agent comprising said picolinamide derivative as active component MEIJI SEIKA KAISHA, LTD. (JP) 2007-02-27 US disclosed
EP-1134214-A1 PICOLINAMIDE DERIVATIVES AND PEST CONTROLLERS CONTAINING THE SAME AS THE ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD. (JP) 2001-09-19 EP disclosed
US-5620995-A Substituted heterocyclic carboxyamides, their preparation and their use as pharmaceuticals HOECHST AKTIENGESELLSCHAFT (DE) 1997-04-15 US disclosed
CN-1126203-A Substituted heterocyclic carboxamides, their preparation and their use as pharmaceuticals HOECHST AG (DE) 1996-07-10 CN disclosed
EP-0661269-A1 Substituted heterocyclic carboxylic acid amides, their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1995-07-05 EP disclosed