SCHEMBL14819086

SCHEMBL14819086

CS/C(=N\C(NC(=O)/C=C/c1cccs1)C(Cl)(Cl)Cl)Nc1cccc2cccnc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.47
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
HPGD P15428 3/20 0.47
SMN1; SMN2 Q16637 8/20 0.41
NPC1 O15118 6/20 0.41
RAB9A P51151 6/20 0.41
ALDH1A1 P00352 5/20 0.41
POLB P06746 3/20 0.41
KDM4E B2RXH2 6/20 0.41
PKM P14618 1/20 0.41
LMNA P02545 4/20 0.40
HTT P42858 2/20 0.40
TP53 P04637 2/20 0.40
PSMD14 O00487 1/20 0.40
GLA P06280 1/20 0.40
RECQL P46063 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
CYP1A2 P05177 1/20 0.40

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
SCHEMBL17508602 0.79 MEN1 (0.75) MAPTMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL14819072 0.79 MEN1 (0.75) MAPTMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL14819071 0.67 TAS1R3 (0.50) MAPTMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL15020438 0.67 TAS1R3 (0.50) MAPTMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL28340851 0.66 POLB (0.57) MAPTMEN1KMT2AHPGDALDH1A1
SCHEMBL14782069 0.65 MEN1 (0.84) MAPTMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL14819076 0.65 MEN1 (0.78) MAPTMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL22879014 0.65 MEN1 (0.62) MAPTMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL15020617 0.65 TAS1R3 (0.58) MAPTMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL16670011 0.65 TAS1R3 (0.58) MAPTMEN1KMT2AHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2573078-B1 ACRYLAMIDE COMPOUNDS AND USE THEREOF FOR INHIBITING APOPTOSIS CHINESE PLA GENERAL HOSPITAL (CN) 2016-11-02 EP disclosed
US-9439881-B2 Acrylamide compounds and use thereof for inhibiting apoptosis CHINESE PLA GENERAL HOSPITAL (CN) 2016-09-13 US disclosed
US-9439881-B2 Acrylamide compounds and use thereof for inhibiting apoptosis CHINESE PLA GENERAL HOSPITAL (CN) 2016-09-13 US disclosed
US-20160038445-A1 ACRYLAMIDE COMPOUNDS AND USE THEREOF FOR INHIBITING APOPTOSIS CHINESE PLA GENERAL HOSPITAL (CN) 2016-02-11 US disclosed
US-20160038445-A1 ACRYLAMIDE COMPOUNDS AND USE THEREOF FOR INHIBITING APOPTOSIS CHINESE PLA GENERAL HOSPITAL (CN) 2016-02-11 US disclosed
US-9199978-B2 Acrylamide compounds and use thereof for inhibiting apoptosis CHINESE PLA GENERAL HOSPITAL (CN) 2015-12-01 US disclosed
US-9199978-B2 Acrylamide compounds and use thereof for inhibiting apoptosis CHINESE PLA GENERAL HOSPITAL (CN) 2015-12-01 US disclosed
US-20130158022-A1 Acrylamide Compounds And Use Thereof For Inhibiting Apoptosis CHINESE PLA GENERAL HOSPITAL (CN) 2013-06-20 US disclosed
US-20130158022-A1 Acrylamide Compounds And Use Thereof For Inhibiting Apoptosis CHINESE PLA GENERAL HOSPITAL (CN) 2013-06-20 US disclosed
EP-2573078-A1 ACRYLAMIDE COMPOUNDS AND USE THEREOF FOR INHIBITING APOPTOSIS Chinese PLA General Hospital (CN) 2013-03-27 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-20160038445-A1 ACRYLAMIDE COMPOUNDS AND USE THEREOF FOR INHIBITING APOPTOSIS BAX, API5, BCL2 MAPT 2397/4885MEN1 4214/4885KMT2A 4693/4885
US-20130158022-A1 Acrylamide Compounds And Use Thereof For Inhibiting Apoptosis BAX, API5, BCL2 MAPT 2397/4885MEN1 4214/4885KMT2A 4693/4885

“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.