SCHEMBL4876732

SCHEMBL4876732

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

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.57
KDM4E B2RXH2 2/20 0.54
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C19 P33261 1/20 0.54
KMT2A Q03164 1/20 0.54
HIF1A Q16665 1/20 0.54
POLB P06746 2/20 0.49
MAPT P10636 2/20 0.49
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA4 P22748 1/20 0.46
CA7 P43166 1/20 0.46
TSHR P16473 1/20 0.45
TERT O14746 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
SCHEMBL4874085 0.82 CASP3 (0.52) MAOAKDM4EMEN1ALDH1A1KMT2A
SCHEMBL4874202 0.81 MAOA (0.51) MAOAALDH1A1MAPTTERT
SCHEMBL593172 0.76 MAPT (0.74) KDM4EMEN1ALDH1A1CYP1A2CYP2C19
SCHEMBL2913783 0.73 POLB (0.61) KDM4EMEN1ALDH1A1CYP1A2CYP2C19
SCHEMBL8752439 0.73 MEN1 (0.66) KDM4EMEN1ALDH1A1CYP1A2CYP2C19
SCHEMBL5947099 0.73 KDM4E (0.71) KDM4EMEN1ALDH1A1KMT2APOLB
SCHEMBL11545428 0.73 ALDH1A1 (0.75) MAOAKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL7765896 0.73 POLB (0.82) KDM4EMEN1ALDH1A1CYP1A2CYP2C19
SCHEMBL15215515 0.72 KMT2A (0.58) KDM4EMEN1ALDH1A1CYP1A2CYP2C19
SCHEMBL2904641 0.72 KMT2A (0.55) KDM4EMEN1ALDH1A1CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0342433-A2 Substituted dibenzothiaphenes AMERICAN CYANAMID COMPANY (US) 1989-11-23 EP claimed
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 MAOA 2786/4885KDM4E 1417/4885MEN1 4760/4885
US-20080070963-A1 Compositions and methods for promoting neural regeneration GAP43, DCX, BDNF MAOA 2786/4885KDM4E 1470/4885MEN1 4720/4885

“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.