SCHEMBL1027461

SCHEMBL1027461

O=C(O)Cc1onc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 4/20 0.41
GLA P06280 2/20 0.41
AKR1B1 P15121 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ACACA Q13085 2/20 0.40
ALDH1A1 P00352 4/20 0.40
IP6K1 Q92551 2/20 0.40
IP6K3 Q96PC2 2/20 0.40
IP6K2 Q9UHH9 2/20 0.40
HSD17B10 Q99714 2/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
PDE3A Q14432 1/20 0.39
LMNA P02545 2/20 0.39
POLB P06746 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38

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
Hydrochloric Acid SCHEMBL5697360 0.98 SMN1; SMN2 (0.42) SMN1; SMN2KDM4EGLAAKR1B1TDP1
SCHEMBL5697386 0.87 MAPT (0.53) SMN1; SMN2KDM4EALDH1A1TP53MAPT
SCHEMBL7155004 0.84 ALDH1A1 (0.40) SMN1; SMN2KDM4EGLAALDH1A1IP6K1
SCHEMBL4779884 0.78 KCNA3 (0.43) ALDH1A1TP53PTGS2MEN1KMT2A
Hydrochloric Acid SCHEMBL4726863 0.77 KCNA3 (0.42) ALDH1A1TP53PTGS2MEN1KMT2A
SCHEMBL6167929 0.77 AURKA (0.39) KDM4EAKR1B1ALDH1A1HSD17B10MAPT
SCHEMBL11203269 0.77 ALDH1A1 (0.49) SMN1; SMN2KDM4EAKR1B1ALDH1A1HSD17B10
SCHEMBL3229873 0.75 LMNA (0.40) SMN1; SMN2KDM4EALDH1A1IP6K1IP6K3
SCHEMBL10395881 0.74 IP6K1 (0.55) KDM4EAKR1B1ALDH1A1IP6K1IP6K3
SCHEMBL8772908 0.74 ALDH1A1 (0.37) SMN1; SMN2KDM4EGLATDP1ALDH1A1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008026217-A1 IMPROVED AND SIMPLIFIED PROCESS FOR THE PREPARATION OF 1,2-BENZISOXAZOLE-3-ACETIC ACID BATTULA SRINIVASA REDDY (IN) 2008-03-06 WO claimed
WO-2007016208-A2 1,2-BENZISOXAZOLE-3-METHANE-SULFONIC ACID AMMONIUM SALT TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2007-02-08 WO claimed
EP-1682522-A1 A PROCESS FOR THE MANUFACTURE OF ZONISAMIDE Wockhardt Limited (IN) 2006-07-26 EP claimed
WO-2005044808-A1 A PROCESS FOR THE MANUFACTURE OF ZONISAMIDE WOCKHARDT LIMITED (IN) 2005-05-19 WO claimed
EP-1373229-A4 PROCESS FOR THE PREPARATION OF 1,2-BENZISOXAZOLE-3-ACETIC ACID TEVA PHARMA (IL) 2005-05-04 EP claimed
EP-1373229-A1 PROCESS FOR THE PREPARATION OF 1,2-BENZISOXAZOLE-3-ACETIC ACID TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2004-01-02 EP claimed
WO-2002070495-A1 PROCESS FOR THE PREPARATION OF 1,2-BENZISOXAZOLE-3-ACETIC ACID TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2002-09-12 WO claimed
EP-2274288-A2 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS Incyte Corporation (US) 2011-01-19 EP disclosed
WO-2009132202-A2 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-10-29 WO disclosed
WO-2008026217-A1 IMPROVED AND SIMPLIFIED PROCESS FOR THE PREPARATION OF 1,2-BENZISOXAZOLE-3-ACETIC ACID BATTULA SRINIVASA REDDY (IN) 2008-03-06 WO disclosed
WO-2007016208-A2 1,2-BENZISOXAZOLE-3-METHANE-SULFONIC ACID AMMONIUM SALT TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2007-02-08 WO disclosed
EP-1682522-A1 A PROCESS FOR THE MANUFACTURE OF ZONISAMIDE Wockhardt Limited (IN) 2006-07-26 EP disclosed
EP-1471923-A4 AMIDO MACROLIDES KOSAN BIOSCIENCES INC (US) 2006-01-11 EP disclosed
EP-1471923-A1 AMIDO MACROLIDES Kosan Biosciences, Inc. (US) 2004-11-03 EP disclosed
EP-1373229-A1 PROCESS FOR THE PREPARATION OF 1,2-BENZISOXAZOLE-3-ACETIC ACID TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2004-01-02 EP disclosed
WO-2003061671-A1 AMIDO MACROLIDES KOSAN BIOSCIENCES, INC. (US) 2003-07-31 WO disclosed
WO-2002070495-A1 PROCESS FOR THE PREPARATION OF 1,2-BENZISOXAZOLE-3-ACETIC ACID TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2002-09-12 WO disclosed
US-6207677-B1 ADMINISERING SIGMA RECEPTOR BINDING PIPERIDINE DERIVATIVE FOR TREATING ANXIETY, EPILEPSY, CONVULSION, MOVEMENT DISORDER, AMNESIA H. LUNDBECK A/S (DK) 2001-03-27 US disclosed
EP-0593511-A1 PIPERIDINE DERIVATES HAVING ANXIOLYTIC EFFECT H. LUNDBECK A/S (DK) 1994-04-27 EP disclosed
WO-1992022554-A1 PIPERIDINE DERIVATES HAVING ANXIOLYTIC EFFECT H. LUNDBECK A/S (DK) 1992-12-23 WO disclosed