SCHEMBL8669402

SCHEMBL8669402

C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC(C(=O)CN)[C@]4(C)[C@H]3C[C@H](O)[C@]12C

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 10/20 0.66
NR1H4 Q96RI1 3/20 0.66
PDE3A Q14432 2/20 0.66
TBXA2R P21731 1/20 0.66
SLC10A2 Q12908 1/20 0.66
MAPT P10636 3/20 0.54
MAPK1 P28482 3/20 0.54
LMNA P02545 3/20 0.54
USP2 O75604 2/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
CYP3A4 P08684 2/20 0.53
CASP7 P55210 3/20 0.52
TP53 P04637 2/20 0.52
HSD17B10 Q99714 2/20 0.52
BLM P54132 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
MDM4 O15151 1/20 0.52
HSPD1 P10809 1/20 0.52
VDR P11473 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
Ammonia Solution, Strong SCHEMBL9068975 0.99 GPBAR1 (0.65) GPBAR1NR1H4PDE3ATBXA2RSLC10A2
Potassium Ion SCHEMBL9070343 0.91 GPBAR1 (0.54) GPBAR1NR1H4PDE3ATBXA2RSLC10A2
SCHEMBL9069691 0.91 GPBAR1 (0.54) GPBAR1NR1H4PDE3ATBXA2RSLC10A2
SCHEMBL9068995 0.91 GPBAR1 (0.54) GPBAR1NR1H4PDE3ATBXA2RSLC10A2
SCHEMBL9069673 0.89 GPBAR1 (0.64) GPBAR1NR1H4PDE3ATBXA2RSLC10A2
Ammonia Solution, Strong SCHEMBL9069311 0.88 GPBAR1 (0.63) GPBAR1NR1H4PDE3ATBXA2RSLC10A2
SCHEMBL3447484 0.88 GPBAR1 (0.76) GPBAR1NR1H4PDE3ATBXA2RSLC10A2
SCHEMBL21631677 0.88 GPBAR1 (0.76) GPBAR1NR1H4PDE3ATBXA2RSLC10A2
SCHEMBL21594795 0.88 GPBAR1 (0.76) GPBAR1NR1H4PDE3ATBXA2RSLC10A2
SCHEMBL7756845 0.88 GPBAR1 (0.76) GPBAR1NR1H4PDE3ATBXA2RSLC10A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130336955-A1 ANTIMICROBIAL FUSION COMPOUNDS AND USES THEREOF VALIANT BIOPHARMA SDN BHD (MY) 2013-12-19 US claimed
EP-2661451-A1 ANTIMICROBIAL FUSION COMPOUNDS AND USES THEREOF Valiant Biopharma SDN BHD (MY) 2013-11-13 EP claimed
WO-2012093931-A1 ANTIMICROBIAL FUSION COMPOUNDS AND USES THEREOF VALIANT BIOPHARMA SDN BHD (MY) 2012-07-12 WO claimed
US-5578304-A Compositions of digestive enzymes and salts of bile acids and process for preparation thereof DIGESTIVE CARE INC. (US) 1996-11-26 US claimed
US-5415872-A Buffers, bile salts, starches or cellulose and adhesives DIGESTIVE CARE INC. (US) 1995-05-16 US claimed
EP-2661451-B1 ANTIMICROBIAL FUSION COMPOUNDS AND USES THEREOF VALIANT BIOPHARMA SDN BHD (MY) 2019-10-09 EP disclosed
US-20160068829-A1 ANTIMICROBIAL FUSION COMPOUNDS AND USES THEREOF VALIANT BIOPHARMA SDN BHD (MY) 2016-03-10 US disclosed
US-9155800-B2 Antimicrobial fusion compounds and uses thereof VALIANT BIOPHARMA SDN BHD (MY) 2015-10-13 US disclosed
US-20150284438-A1 DOSAGE REGIME OF FUSION COMPOUNDS BIOVALENCE SDN. BHD. (MY) 2015-10-08 US disclosed
US-20150202250-A1 ANTICANCER TREATMENT BIOVALENCE SDN. BHD. (MY) 2015-07-23 US disclosed
EP-2864362-A1 ANTICANCER TREATMENT Biovalence Sdn. Bhd. (MY) 2015-04-29 EP disclosed
EP-2864361-A1 DOSAGE REGIME OF FUSION COMPOUNDS Biovalence Sdn. Bhd. (MY) 2015-04-29 EP disclosed
WO-2014003536-A9 DOSAGE REGIME OF FUSION COMPOUNDS BIOVALENCE SDN. BHD. (MY) 2014-01-30 WO disclosed
WO-2014003536-A1 DOSAGE REGIME OF FUSION COMPOUNDS BIOVALENCE SDN. BHD. (MY) 2014-01-03 WO disclosed
WO-2014003537-A1 ANTICANCER TREATMENT BIOVALENCE SDN. BHD. (MY) 2014-01-03 WO disclosed
US-20130336955-A1 ANTIMICROBIAL FUSION COMPOUNDS AND USES THEREOF VALIANT BIOPHARMA SDN BHD (MY) 2013-12-19 US disclosed
EP-2661451-A1 ANTIMICROBIAL FUSION COMPOUNDS AND USES THEREOF Valiant Biopharma SDN BHD (MY) 2013-11-13 EP disclosed
WO-2012093931-A1 ANTIMICROBIAL FUSION COMPOUNDS AND USES THEREOF VALIANT BIOPHARMA SDN BHD (MY) 2012-07-12 WO disclosed
US-5750104-A BUFFER ADDED FOR SIDE EFFECT REDUCTION WHILE MAINTAINING ENZYME ACTIVITY DIGESTIVE CARE INC. (US) 1998-05-12 US disclosed
US-5415872-A Buffers, bile salts, starches or cellulose and adhesives DIGESTIVE CARE INC. (US) 1995-05-16 US disclosed