SCHEMBL4869345

SCHEMBL4869345

O=C(Nc1ccc2c(c1)S(=O)(=O)c1cc(NC(=O)c3ccccc3)ccc1-2)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.68
CA2 P00918 1/20 0.68
CA9 Q16790 1/20 0.68
ACE2 Q9BYF1 1/20 0.60
KCNK3 O14649 1/20 0.59
KCNK9 Q9NPC2 1/20 0.59
RAB9A P51151 6/20 0.55
NPC1 O15118 5/20 0.55
HDAC1 Q13547 1/20 0.55
HDAC2 Q92769 1/20 0.55
PTPN1 P18031 1/20 0.54
CASP3 P42574 2/20 0.54
MAOA P21397 1/20 0.54
KMT2A Q03164 4/20 0.53
SIRT1 Q96EB6 2/20 0.53
MEN1 O00255 2/20 0.53
KDM4E B2RXH2 1/20 0.53
POLB P06746 1/20 0.53
PKM P14618 1/20 0.53
TP53 P04637 1/20 0.53

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
SCHEMBL25970455 0.92 NPC1 (0.63) CA12CA2CA9ACE2KCNK3
SCHEMBL7846927 0.84 CA12 (0.69) CA12CA2CA9KCNK3RAB9A
SCHEMBL22580596 0.79 NPC1 (0.55) CA12CA2CA9RAB9ANPC1
SCHEMBL13576567 0.77 MEN1 (0.63) RAB9ANPC1HDAC1MAOAKMT2A
SCHEMBL4289564 0.77 ACE2 (0.97) CA12CA2CA9ACE2KCNK3
SCHEMBL25970373 0.77 ACE2 (0.97) CA12CA2CA9ACE2KCNK3
SCHEMBL126415 0.76 PTPN1 (0.87) KCNK3KCNK9RAB9ANPC1HDAC2
SCHEMBL5991622 0.76 KMT2A (0.64) CA12CA9KCNK3KCNK9RAB9A
SCHEMBL17348042 0.76 PLCG2 (0.59) CA12CA2CA9ACE2KCNK3
SCHEMBL8528763 0.75 ACE2 (1.00) CA12CA2CA9ACE2KCNK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080070963-A1 Compositions and methods for promoting neural regeneration Neuberger, Timothy 2008-03-20 US disclosed
US-7271187-B2 Compositions and methods for promoting tissue regeneration Neuberger, Tim (US) 2007-09-18 US disclosed
US-20020055530-A1 Compositions and methods for promoting tissue regeneration URI HERZBERG 2002-05-09 US disclosed
WO-2001076592-A1 COMPOSITIONS AND METHODS FOR PROMOTING NEURAL REGENERATION ACORDA THERAPEUTICS, INC. (US) 2001-10-18 WO disclosed
US-4965284-A IMMUNOMODULATORS AMERICAN CYANAMID COMPANY (US) 1990-10-23 US disclosed
EP-0342433-A2 Substituted dibenzothiaphenes AMERICAN CYANAMID COMPANY (US) 1989-11-23 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020055530-A1 Compositions and methods for promoting tissue regeneration TST, DCX, GAP43 CA12 2737/4885CA2 2426/4885CA9 2919/4885
US-20080070963-A1 Compositions and methods for promoting neural regeneration GAP43, DCX, BDNF CA12 2513/4885CA2 2364/4885CA9 2888/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.